7p Block Quadruple-Zeta Basis Set Archive ========================================= Date: 01 May 2012 When publishing work that uses these basis sets, please use the following citation: K.G. Dyall, Theor. Chem. Acc. (2012) 131, 1172. DOI: 10.1007/s00214-012-1172-4. Basis sets are available from the Dirac web site, http://dirac.chem.sdu.dk. For the core correlating functions for n=1 to n=5, please use the following citation: K.G. Dyall, Theor. Chem. Acc. (2012) 131, 1217. DOI: 10.1007/s00214-012-1217-8. Basis sets are available from the Dirac web site, http://dirac.chem.sdu.dk. This archive contains the exponents and the SCF spinor or orbital coefficients, given with respect to normalized (spherical or 2-spinor) Gaussian functions, for the double-zeta basis sets described in the above article. NOTE: Functions are counted from the function with the smallest exponent to the largest. The SCF exponent sets were generated as follows: * Optimization of the s, p, d, and f sets separately, on the total energy of the configuration average of the s^2 p^n configuration, to yield a 35s 35p 24d 14f set. * Replacement of the outermost 2 SCF f exponents with the 6d correlating 3f exponent set, and reoptimization of the other 12 f exponents with the correlating f exponents fixed. * Addition of the outer valence correlating f exponent to the SCF set without reoptimization The resulting primitive basis set is a 35s 35p 24d 16f set. In all the following descriptions, this is the set referred to as the SCF exponent set. The correlating exponents were generated as follows * A 3d2f1g exponent set for 7s7p correlation was optimized in MR-SDCI calculations on the ground configuration, with 3 s and 3 p exponents from the SCF set included in the correlating space and held fixed. * A 3f2g1h exponent set for 6d correlation was optimized in MR-SDCI calculations on the ground configuration, with double excitations from the 6d shell into the f shell coupled to J=0. * The largest f exponent from the valence set was replaced by the smallest f exponent from the 6d set, and the smallest valence f exponent was reoptimized. * The valence correlating d set was replaced in the final selection with the SCF exponents. * The inner core exponents were optimized in MR-SDCI calculations on the ground configuration, with double excitations from the specified shell into the correlating spinors, coupled to J=0. Only the shell of the highest angular momentum was correlated except for n=2; the correlating sets were 3p2d1f for the 1s, 3d2f1g for the 2s2p, 3f2g1h for the 3d, and 3g2h1i for the 4f and 5f. For the 1s, 2s2p, and 3d correlation, exponents from the occupied symmetries were used and frozen and the rest were optimized. The smallest g exponent from the 3d correlating set replaced the largest g exponent from the 4f correlating set and was held fixed while the remaining exponents were optimized, to reduce linear dependence. The diffuse exponent sets were generated as follows. * An s exponent and a p exponent were optimized in SCF calculations on the negative ion for Uut - Uus, with the remaining s and p exponents fixed * A dfg exponent set was optimized in MR-SDCI calculations on the negative ion for Uut - Uus, with 3 s and 3 p exponents from the SCF set, the correlating 3d2f1g set, and the diffuse sp set included in the correlating space, i.e. a 4s4p4d3f2g correlating space. * The s and p exponents were extrapolated in a geometric sequence from Uuh and Uus to obtain exponents for Uuo. The d, f, and g exponents for Uuo were determined by multiplying the smallest correlating exponent for Uuo by the ratio of the diffuse exponent to the smallest correlating exponent for Uus. This archive contains the exponents and the SCF spinor or orbital coefficients, given with respect to normalized (spherical or 2-spinor) Gaussian functions, for the basis sets described in the above articles. The SCF exponent sets include the valence correlating d functions and f functions. The d functions are in fact the SCF functions for the 6d. The outermost two exponents of the f set were replaced by the core 6d correlating f exponents, and the remaining f exponents were reoptimized. The outermost of these f exponents was used for the valence correlation, and the outermost valence f exponent was reoptimized with the other f exponent held fixed. In all the following descriptions, this is the set referred to as the SCF exponent set. The diffuse functions were optimized in correlated calculations on the negative ion. The archive is set out as follows. 1. Exponents and SCF coefficients for Dirac-Hartree-Fock wave functions, in order of Z. The large component functions are given first, followed by the small component functions. Both components are labelled with the large component symmetry type, but the primitive functions for the small component are those obtained by restricted kinetic balance from the large component. The spin-orbit components are labeled with "-" for j=l-1/2 and "+" for j=l+1/2. 2. Exponents and SCF coefficients for spin-free modified Dirac-Hartree-Fock wave functions, in order of Z. The large component functions are given first, followed by the pseudo-large component functions, then the Foldy-Wouthuysen transformed large component functions. Note that all components have the same symmetry type. 3. Exponents of diffuse s, p, d, f, and g functions. 4. Exponents of valence and core correlating functions. Basis set construction. ---------------------- Several different types of basis sets may be constructed by adding primitive functions. These basis sets are described below. NOTE: Functions are counted from the function with the smallest exponent to the largest. 1. Valence flexibility. To the SCF functions, add the following: 1st, 2nd, and 4th s primitives from the SCF set 2nd, 3rd, and 5th p primitives from the SCF set 1st, 2nd, and 3rd d primitives from the SCF set 1st and 2nd f primitives from the SCF set (correlating f primitives) valence correlating 1g 2. Valence + outer core. This set adds correlation of the 6d shell. To set 1, add the following: 5th, and 6th s primitives from the SCF set 6th and 7th p primitives from the SCF set 4th d primitive from the SCF set 3rd and 4th f primitive from the SCF set (6d correlating f primitives) outer core correlating 2g1h 3. Inner core correlation. Add the correlating functions to the basis sets for the desired shells, and uncontract three functions from each of the shells of the same principal quantum number. These should be chosen to span the radial maxima of the shells. Note that the smallest g exponent of the 3d correlating set is the same as the largest g exponent of the 4f correlating set. 4. Diffuse basis: add the diffuse s, p, d, f, and g functions to any of the above basis sets. Dirac-Hartree-Fock basis sets ============================= ** Uut 287 ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2719640E+07 1.6758954E-03 -7.8598920E-04 3.9138771E-04 2.1107068E-04 -1.1442971E-04 5.7188050E-05 2.1319852E-05 2 1.4018117E+07 3.6944039E-03 -1.7439646E-03 8.6946580E-04 4.6904013E-04 -2.5430858E-04 1.2709812E-04 4.7382805E-05 3 4.7691592E+06 6.6800229E-03 -3.1764542E-03 1.5857802E-03 8.5576365E-04 -4.6403631E-04 2.3192290E-04 8.6462457E-05 4 1.7943097E+06 1.0910533E-02 -5.2469884E-03 2.6248547E-03 1.4172566E-03 -7.6862360E-04 3.8417131E-04 1.4322336E-04 5 7.3981554E+05 1.7384195E-02 -8.4694284E-03 4.2468460E-03 2.2944338E-03 -1.2445830E-03 6.2209809E-04 2.3192698E-04 6 3.2295501E+05 2.6834055E-02 -1.3304949E-02 6.6924089E-03 3.6186050E-03 -1.9633025E-03 9.8141095E-04 3.6589112E-04 7 1.4881309E+05 4.0987971E-02 -2.0719558E-02 1.0457510E-02 5.6594427E-03 -3.0714680E-03 1.5354845E-03 5.7246580E-04 8 7.1367052E+04 6.1522372E-02 -3.1831206E-02 1.6131419E-02 8.7391814E-03 -4.7441606E-03 2.3718853E-03 8.8432606E-04 9 3.5520681E+04 9.0576253E-02 -4.8014092E-02 2.4438295E-02 1.3254694E-02 -7.1984526E-03 3.5993464E-03 1.3419630E-03 10 1.8216486E+04 1.2820623E-01 -6.9824989E-02 3.5716909E-02 1.9396368E-02 -1.0536579E-02 5.2688938E-03 1.9645582E-03 11 9.6229816E+03 1.6836857E-01 -9.3933157E-02 4.8258248E-02 2.6238489E-02 -1.4261681E-02 7.1327525E-03 2.6593665E-03 12 5.2295339E+03 1.9459306E-01 -1.0909453E-01 5.5926768E-02 3.0377754E-02 -1.6498571E-02 8.2498449E-03 3.0762894E-03 13 2.9214734E+03 1.8296597E-01 -8.9714218E-02 4.3242427E-02 2.3030784E-02 -1.2447141E-02 6.2144488E-03 2.3153375E-03 14 1.6736199E+03 1.2337607E-01 -2.9948287E-03 -1.3966051E-02 -1.0329992E-02 6.1165533E-03 -3.1320640E-03 -1.1712813E-03 15 9.8820875E+02 4.9620698E-02 1.5954174E-01 -1.3634322E-01 -8.4357409E-02 4.7570896E-02 -2.4048894E-02 -8.9923130E-03 16 5.9356725E+02 1.0145685E-02 3.2796171E-01 -3.0412504E-01 -1.9450870E-01 1.1120400E-01 -5.6435488E-02 -2.1095575E-02 17 3.6125652E+02 1.7605510E-04 3.5300861E-01 -3.7633379E-01 -2.5073324E-01 1.4457443E-01 -7.3565217E-02 -2.7553251E-02 18 2.2223702E+02 4.2676502E-04 1.9933655E-01 -1.6303781E-01 -1.0315120E-01 6.0551891E-02 -3.1027726E-02 -1.1577192E-02 19 1.3980540E+02 -4.3224238E-04 4.8293444E-02 3.1559988E-01 3.5163890E-01 -2.3974052E-01 1.2815961E-01 4.8356331E-02 20 8.8585590E+01 3.8004523E-04 5.8698246E-03 5.8059273E-01 7.7228759E-01 -5.5076448E-01 2.9774959E-01 1.1303328E-01 21 5.6149197E+01 -3.8925939E-04 -8.8286324E-04 3.7465620E-01 5.0549236E-01 -3.6792090E-01 2.0231696E-01 7.6616598E-02 22 3.5546788E+01 4.3375544E-04 9.9900563E-04 9.3558013E-02 -2.5488399E-01 2.8182127E-01 -1.6323275E-01 -6.1799406E-02 23 2.4318016E+01 -4.3994800E-04 -1.1510002E-03 6.3337940E-03 -7.0106593E-01 9.7929140E-01 -6.7613027E-01 -2.7183269E-01 24 1.6404019E+01 3.6420283E-04 8.6524084E-04 2.3901660E-03 -5.0400374E-01 8.3121401E-01 -5.6394036E-01 -2.2047166E-01 25 1.1201716E+01 -2.4552121E-04 -5.8750949E-04 -7.2933714E-04 -1.5057166E-01 -1.1210560E-01 1.6110121E-01 6.5690163E-02 26 7.2464938E+00 1.3515966E-04 3.3764311E-04 1.3314210E-04 -2.5750163E-02 -8.2314119E-01 9.3656159E-01 4.1691800E-01 27 4.6003323E+00 -7.2161880E-05 -1.7129476E-04 -1.7653481E-04 1.8469343E-03 -6.8624661E-01 9.0999827E-01 4.3444504E-01 28 2.5948426E+00 4.8939061E-05 1.1921521E-04 7.3866147E-05 -2.0133545E-03 -1.5895347E-01 -1.1645111E-01 -7.8767243E-02 29 1.7184194E+00 -4.2032179E-05 -1.0339938E-04 -5.5541027E-05 1.7008686E-03 2.2931103E-02 -7.4708265E-01 -5.4246847E-01 30 1.0873304E+00 2.8919216E-05 7.0537389E-05 4.4609638E-05 -1.1036780E-03 -1.5524525E-02 -5.0810397E-01 -4.1196878E-01 31 7.3659376E-01 -1.6413498E-05 -4.0386712E-05 -2.2426480E-05 6.5283159E-04 7.4791352E-03 -1.9596752E-01 -2.4204496E-01 32 4.7125807E-01 5.1782755E-06 1.2686087E-05 7.7226667E-06 -2.0121359E-04 -2.1576043E-03 -6.0380101E-02 1.9100934E-01 33 2.2988689E-01 -9.7647194E-07 -2.4046477E-06 -1.3592358E-06 3.9254036E-05 3.9797255E-04 -4.4858406E-03 6.3044315E-01 34 1.1152686E-01 2.6367815E-07 6.5111653E-07 3.5829797E-07 -1.0733458E-05 -1.0332621E-04 -2.9605891E-05 4.9027568E-01 35 5.0196440E-02 -4.9302339E-08 -1.2084166E-07 -7.4549830E-08 1.9620117E-06 1.9460972E-05 4.0607535E-06 8.5256168E-02 2p- 3p- 4p- 5p- 6p- 7p- 1 8.7882223E+07 7.3535364E-05 -3.8815841E-05 2.1014346E-05 -1.1218230E-05 -5.3546617E-06 -1.5357697E-06 2 3.7925146E+07 3.2733785E-04 -1.7273929E-04 9.3511916E-05 -4.9918561E-05 -2.3826597E-05 -6.8336966E-06 3 1.6097922E+07 7.0054167E-04 -3.6973034E-04 2.0015942E-04 -1.0685114E-04 -5.1001705E-05 -1.4627784E-05 4 7.0050657E+06 1.2456175E-03 -6.5752230E-04 3.5597552E-04 -1.9003110E-04 -9.0704091E-05 -2.6014831E-05 5 3.1199170E+06 2.0453344E-03 -1.0799375E-03 5.8470555E-04 -3.1214409E-04 -1.4899290E-04 -4.2732673E-05 6 1.4185524E+06 3.2321559E-03 -1.7071868E-03 9.2439779E-04 -4.9349396E-04 -2.3555248E-04 -6.7558935E-05 7 6.5664636E+05 4.9984639E-03 -2.6415366E-03 1.4305277E-03 -7.6374078E-04 -3.6455859E-04 -1.0455943E-04 8 3.0901950E+05 7.6513272E-03 -4.0471265E-03 2.1922335E-03 -1.1704518E-03 -5.5868631E-04 -1.6023798E-04 9 1.4768105E+05 1.1687987E-02 -6.1914613E-03 3.3550928E-03 -1.7915917E-03 -8.5524166E-04 -2.4529484E-04 10 7.1613099E+04 1.7961293E-02 -9.5394439E-03 5.1728247E-03 -2.7626253E-03 -1.3187539E-03 -3.7824027E-04 11 3.5229671E+04 2.7936137E-02 -1.4900557E-02 8.0890490E-03 -4.3218832E-03 -2.0634816E-03 -5.9184896E-04 12 1.7604081E+04 4.4122645E-02 -2.3698767E-02 1.2888604E-02 -6.8889741E-03 -3.2890970E-03 -9.4340623E-04 13 8.9556177E+03 7.0589512E-02 -3.8303024E-02 2.0887329E-02 -1.1175195E-02 -5.3379090E-03 -1.5311166E-03 14 4.6486654E+03 1.1261049E-01 -6.1969477E-02 3.3916227E-02 -1.8160192E-02 -8.6739383E-03 -2.4881539E-03 15 2.4651972E+03 1.7238912E-01 -9.6238575E-02 5.2867107E-02 -2.8349323E-02 -1.3551443E-02 -3.8874574E-03 16 1.3352849E+03 2.3673530E-01 -1.3243568E-01 7.2717378E-02 -3.8958538E-02 -1.8606082E-02 -5.3374517E-03 17 7.3853195E+02 2.6209836E-01 -1.3376666E-01 7.0677641E-02 -3.7432043E-02 -1.7842419E-02 -5.1149112E-03 18 4.1658693E+02 1.9966161E-01 -2.8756846E-02 -4.3254876E-03 6.0442091E-03 3.4369595E-03 1.0108613E-03 19 2.3886203E+02 8.4210410E-02 2.0826223E-01 -1.8406875E-01 1.1166118E-01 5.5080938E-02 1.5894038E-02 20 1.3924505E+02 1.4059152E-02 4.1473961E-01 -3.6833966E-01 2.2796544E-01 1.1350898E-01 3.2781843E-02 21 8.2537435E+01 8.9422789E-04 3.4186397E-01 -2.4470590E-01 1.3126559E-01 6.1738591E-02 1.7676130E-02 22 4.8960936E+01 -1.6051110E-04 1.2052518E-01 2.4234962E-01 -2.4916037E-01 -1.3811346E-01 -4.0680374E-02 23 2.9261456E+01 5.3560969E-05 1.2089094E-02 5.7498443E-01 -5.9351684E-01 -3.4592391E-01 -1.0266826E-01 24 1.7786803E+01 -9.5932984E-05 1.5234518E-03 3.5135731E-01 -2.6330770E-01 -1.1923828E-01 -3.3538820E-02 25 1.0661314E+01 6.2455857E-05 -6.9748633E-04 7.5381638E-02 4.8592908E-01 4.3075323E-01 1.3645152E-01 26 6.2850853E+00 -3.2850550E-05 3.3429796E-04 2.0558867E-03 6.2583351E-01 5.6001235E-01 1.8051358E-01 27 3.6862451E+00 2.5039076E-05 -2.6682490E-04 1.2662718E-03 2.2550311E-01 5.2527707E-03 -1.1340708E-02 28 2.1219448E+00 -1.4422985E-05 1.5225402E-04 -6.9128093E-04 2.5481870E-02 -5.5643117E-01 -2.4485957E-01 29 1.1993318E+00 7.7923757E-06 -8.3198470E-05 3.5506982E-04 2.2813000E-04 -4.9919758E-01 -2.2859159E-01 30 6.6134078E-01 -4.3122191E-06 4.5511879E-05 -1.9586445E-04 2.4552661E-04 -1.7222788E-01 -2.1443961E-02 31 3.5182344E-01 1.9677260E-06 -2.1160504E-05 9.4556917E-05 -2.5575771E-04 -2.3718183E-02 2.3721318E-01 32 1.7204980E-01 -8.9413938E-07 9.5349199E-06 -4.1492189E-05 6.0908949E-05 -2.6229760E-03 4.2978885E-01 33 8.1358919E-02 4.1880402E-07 -4.4866684E-06 1.9921596E-05 -4.1074922E-05 -4.1612061E-05 3.8450761E-01 34 3.8116773E-02 -1.7895147E-07 1.9191284E-06 -8.4978184E-06 1.6543379E-05 -7.1042655E-05 1.2919525E-01 35 1.7566317E-02 4.9543212E-08 -5.3134730E-07 2.3593012E-06 -4.7112003E-06 1.4974875E-05 4.9229862E-03 2p+ 3p+ 4p+ 5p+ 6p+ 7p+ 1 8.7882223E+07 1.6723531E-07 -9.5577196E-08 5.3285416E-08 -2.8459912E-08 1.2535402E-08 -2.7464126E-09 2 3.7925146E+07 5.5740701E-07 -3.1848087E-07 1.7672790E-07 -9.3631476E-08 4.1010527E-08 -8.9767388E-09 3 1.6097922E+07 1.6207766E-06 -9.2709741E-07 5.1666181E-07 -2.7566733E-07 1.2133032E-07 -2.6579369E-08 4 7.0050657E+06 4.1956130E-06 -2.4005931E-06 1.3337065E-06 -7.0769689E-07 3.1029001E-07 -6.7930505E-08 5 3.1199170E+06 1.0820866E-05 -6.2001060E-06 3.4548352E-06 -1.8417388E-06 8.1007610E-07 -1.7744074E-07 6 1.4185524E+06 2.7385205E-05 -1.5708415E-05 8.7370647E-06 -4.6406988E-06 2.0359479E-06 -4.4576620E-07 7 6.5664636E+05 6.9166460E-05 -3.9758782E-05 2.2166358E-05 -1.1812854E-05 5.1940776E-06 -1.1376565E-06 8 3.0901950E+05 1.7439536E-04 -1.0046725E-04 5.5958952E-05 -2.9745728E-05 1.3055062E-05 -2.8585593E-06 9 1.4768105E+05 4.4125096E-04 -2.5501240E-04 1.4235284E-04 -7.5868826E-05 3.3355223E-05 -7.3056103E-06 10 7.1613099E+04 1.1217428E-03 -6.5059861E-04 3.6308756E-04 -1.9315830E-04 8.4802735E-05 -1.8569514E-05 11 3.5229671E+04 2.8562926E-03 -1.6645533E-03 9.3115443E-04 -4.9648701E-04 2.1828161E-04 -4.7808982E-05 12 1.7604081E+04 7.2121826E-03 -4.2282613E-03 2.3668209E-03 -1.2604018E-03 5.5354501E-04 -1.2121770E-04 13 8.9556177E+03 1.7765154E-02 -1.0507925E-02 5.9016991E-03 -3.1501593E-03 1.3853031E-03 -3.0342486E-04 14 4.6486654E+03 4.1721876E-02 -2.5007042E-02 1.4083947E-02 -7.5138387E-03 3.3015809E-03 -7.2304674E-04 15 2.4651972E+03 9.0312601E-02 -5.5233377E-02 3.1313608E-02 -1.6761360E-02 7.3765457E-03 -1.6158736E-03 16 1.3352849E+03 1.7135618E-01 -1.0774098E-01 6.1504794E-02 -3.2938026E-02 1.4486063E-02 -3.1728487E-03 17 7.3853195E+02 2.6396922E-01 -1.7091935E-01 9.8579875E-02 -5.3066975E-02 2.3395515E-02 -5.1262611E-03 18 4.1658693E+02 2.9415037E-01 -1.7877448E-01 9.9788174E-02 -5.2902954E-02 2.3177806E-02 -5.0735443E-03 19 2.3886203E+02 2.0272232E-01 -2.3265414E-02 -1.2712708E-02 1.1113224E-02 -5.3323771E-03 1.1814959E-03 20 1.3924505E+02 6.7702680E-02 2.8995384E-01 -2.7235722E-01 1.6846902E-01 -7.7114711E-02 1.6988606E-02 21 8.2537435E+01 7.8615919E-03 4.6021423E-01 -4.3677835E-01 2.6710008E-01 -1.2121902E-01 2.6666275E-02 22 4.8960936E+01 1.9448244E-04 2.9256595E-01 -1.4422733E-01 6.2885603E-02 -2.6514233E-02 5.7760060E-03 23 2.9261456E+01 -1.0663097E-04 6.8754918E-02 4.3261151E-01 -4.3404194E-01 2.2648999E-01 -5.0850619E-02 24 1.7786803E+01 -4.0180351E-05 5.3425678E-03 5.6807809E-01 -6.1447472E-01 3.2013237E-01 -7.1768768E-02 25 1.0661314E+01 2.0654723E-05 -4.0240432E-04 2.3446027E-01 4.0514937E-02 -7.4304958E-02 1.8420626E-02 26 6.2850853E+00 -9.6465767E-07 8.7740769E-05 2.8306682E-02 6.5021312E-01 -5.0874248E-01 1.2097983E-01 27 3.6862451E+00 9.5694778E-06 -2.2238739E-04 1.9412306E-03 4.8196485E-01 -3.9561632E-01 9.5474026E-02 28 2.1219448E+00 -4.8431357E-06 1.1670184E-04 -4.0434570E-04 1.1337605E-01 2.1268739E-01 -6.6835155E-02 29 1.1993318E+00 2.2497503E-06 -6.1466519E-05 1.6280750E-04 7.7306661E-03 5.6175156E-01 -1.7569355E-01 30 6.6134078E-01 -1.6163811E-06 3.7519408E-05 -1.3731941E-04 5.1158257E-04 4.0130017E-01 -1.3543664E-01 31 3.5182344E-01 6.2402715E-07 -1.6491198E-05 5.4767357E-05 -9.8070239E-05 1.2393559E-01 5.2587530E-03 32 1.7204980E-01 -3.1633324E-07 7.7364801E-06 -2.6095963E-05 -1.5100367E-05 1.3587838E-02 1.9838282E-01 33 8.1358919E-02 1.4507181E-07 -3.6196297E-06 1.2515524E-05 -9.5111695E-06 7.8447102E-04 3.9311520E-01 34 3.8116773E-02 -6.0993515E-08 1.5418340E-06 -5.2200315E-06 -2.4064815E-07 1.6402553E-04 4.1785747E-01 35 1.7566317E-02 1.7505682E-08 -4.3248236E-07 1.5104626E-06 -1.1161477E-06 4.9479636E-05 1.4169391E-01 3d- 4d- 5d- 6d- 1 1.1671412E+06 9.2553049E-06 -5.5994830E-06 2.8927425E-06 -1.0383579E-06 2 2.6691682E+05 3.9647111E-05 -2.3989729E-05 1.2392281E-05 -4.4481874E-06 3 8.2116423E+04 1.4057158E-04 -8.5136958E-05 4.3997596E-05 -1.5794222E-05 4 2.9783340E+04 4.4876059E-04 -2.7205836E-04 1.4060061E-04 -5.0473566E-05 5 1.2124264E+04 1.3646108E-03 -8.2968168E-04 4.2925054E-04 -1.5412983E-04 6 5.3960761E+03 4.0607323E-03 -2.4770458E-03 1.2822128E-03 -4.6046052E-04 7 2.5813010E+03 1.1731120E-02 -7.2023527E-03 3.7364079E-03 -1.3424247E-03 8 1.3086162E+03 3.1803024E-02 -1.9672379E-02 1.0221582E-02 -3.6737634E-03 9 6.9434397E+02 7.7796757E-02 -4.8780821E-02 2.5456235E-02 -9.1579548E-03 10 3.8229501E+02 1.6219228E-01 -1.0258064E-01 5.3611307E-02 -1.9292968E-02 11 2.1624254E+02 2.6671680E-01 -1.6670573E-01 8.6943346E-02 -3.1274832E-02 12 1.2498461E+02 3.1590106E-01 -1.7446543E-01 8.6464317E-02 -3.0707046E-02 13 7.3145142E+01 2.3455020E-01 -1.3018976E-02 -1.9937979E-02 9.4576555E-03 14 4.3011978E+01 9.2841211E-02 2.7569464E-01 -2.0977909E-01 8.1324654E-02 15 2.5495125E+01 1.4512311E-02 4.4172991E-01 -3.2375192E-01 1.2486813E-01 16 1.5154401E+01 8.6513459E-04 2.9456471E-01 -7.5721832E-02 1.1124992E-02 17 8.9264900E+00 -1.9644979E-04 8.2662414E-02 3.6100324E-01 -1.8800108E-01 18 5.1621578E+00 -5.4663445E-06 7.4493957E-03 4.9590930E-01 -2.5030940E-01 19 2.9319801E+00 -5.6955850E-05 3.8605775E-04 2.6398121E-01 -3.5179156E-02 20 1.6103860E+00 1.4490774E-05 -4.2770314E-05 5.3574204E-02 2.8999624E-01 21 8.5312386E-01 -9.6298104E-06 1.9954734E-05 3.0310799E-03 4.2608339E-01 22 4.3318267E-01 4.1507874E-06 -1.0891324E-05 2.8189732E-04 3.2935941E-01 23 2.0988029E-01 -1.6450635E-06 4.4936545E-06 -5.6088381E-05 1.4155279E-01 24 9.3438434E-02 4.2625223E-07 -1.0133302E-06 9.6552503E-06 1.9725807E-02 3d+ 4d+ 5d+ 6d+ 1 1.1671412E+06 1.6460316E-07 -1.0063665E-07 5.1834551E-08 -1.7632078E-08 2 2.6691682E+05 1.7209074E-06 -1.0496033E-06 5.3969711E-07 -1.8366264E-07 3 8.2116423E+04 1.2661965E-05 -7.7509703E-06 3.9923061E-06 -1.3583798E-06 4 2.9783340E+04 7.5997451E-05 -4.6514928E-05 2.3945270E-05 -8.1494633E-06 5 1.2124264E+04 3.8828563E-04 -2.3843507E-04 1.2289943E-04 -4.1827077E-05 6 5.3960761E+03 1.7226366E-03 -1.0600334E-03 5.4653260E-04 -1.8605501E-04 7 2.5813010E+03 6.6328732E-03 -4.1049926E-03 2.1202901E-03 -7.2196237E-04 8 1.3086162E+03 2.1942690E-02 -1.3673969E-02 7.0745479E-03 -2.4101115E-03 9 6.9434397E+02 6.1344141E-02 -3.8757696E-02 2.0133767E-02 -6.8641299E-03 10 3.8229501E+02 1.4060430E-01 -8.9958207E-02 4.6873460E-02 -1.5992735E-02 11 2.1624254E+02 2.5061852E-01 -1.5987289E-01 8.3303305E-02 -2.8419049E-02 12 1.2498461E+02 3.2145354E-01 -1.8925677E-01 9.5668816E-02 -3.2408653E-02 13 7.3145142E+01 2.5981580E-01 -5.7387390E-02 8.3918593E-03 -1.1574460E-03 14 4.3011978E+01 1.1410503E-01 2.3002693E-01 -1.7828344E-01 6.5546079E-02 15 2.5495125E+01 2.0603704E-02 4.4296173E-01 -3.2874952E-01 1.2049164E-01 16 1.5154401E+01 1.4049072E-03 3.3183367E-01 -1.3766882E-01 3.7458290E-02 17 8.9264900E+00 -1.8791174E-04 1.0542110E-01 3.0487262E-01 -1.5076504E-01 18 5.1621578E+00 -1.5685667E-05 1.1402852E-02 5.0732790E-01 -2.4385205E-01 19 2.9319801E+00 -6.9383948E-05 6.4727135E-04 3.0724011E-01 -8.2789193E-02 20 1.6103860E+00 1.5940575E-05 -6.3334815E-06 7.2093180E-02 2.2930522E-01 21 8.5312386E-01 -1.1043183E-05 1.0139709E-05 5.0644563E-03 4.0965311E-01 22 4.3318267E-01 4.8724830E-06 -1.0712890E-05 4.9216710E-04 3.6248447E-01 23 2.0988029E-01 -1.9040787E-06 3.5887282E-06 -6.1114057E-05 1.8862996E-01 24 9.3438434E-02 4.9610675E-07 -8.0161399E-07 1.2948959E-05 3.8905050E-02 4f- 5f- 1 6.6678464E+03 8.1004995E-05 -3.9486352E-05 2 2.1345513E+03 6.2974948E-04 -3.0876429E-04 3 8.8310589E+02 3.5669044E-03 -1.7469787E-03 4 4.1621459E+02 1.5750747E-02 -7.7691909E-03 5 2.1293537E+02 5.2351491E-02 -2.5824840E-02 6 1.1439928E+02 1.3329089E-01 -6.6260182E-02 7 6.3659645E+01 2.5029782E-01 -1.2033603E-01 8 3.5985904E+01 3.3344219E-01 -1.4545163E-01 9 2.0594089E+01 2.9065926E-01 -6.1324846E-02 10 1.1743615E+01 1.4367283E-01 1.6738518E-01 11 6.5450100E+00 3.1781393E-02 3.7213029E-01 12 3.5557317E+00 1.7856529E-03 3.8225993E-01 13 1.8463768E+00 8.4738679E-05 2.1369839E-01 14 8.8758782E-01 -6.4505707E-05 5.4113503E-02 15 3.7354701E-01 1.3886443E-05 3.4740298E-03 16 2.1624908E-01 -9.0933588E-06 2.6171875E-04 4f+ 5f+ 1 6.6678464E+03 3.0807199E-05 -1.4885714E-05 2 2.1345513E+03 3.8189441E-04 -1.8623229E-04 3 8.8310589E+02 2.6957690E-03 -1.3113824E-03 4 4.1621459E+02 1.3259710E-02 -6.4994548E-03 5 2.1293537E+02 4.7247104E-02 -2.3161055E-02 6 1.1439928E+02 1.2543497E-01 -6.2004384E-02 7 6.3659645E+01 2.4194913E-01 -1.1626847E-01 8 3.5985904E+01 3.3253033E-01 -1.4611219E-01 9 2.0594089E+01 2.9909489E-01 -7.1894621E-02 10 1.1743615E+01 1.5303642E-01 1.4975497E-01 11 6.5450100E+00 3.5715752E-02 3.6382758E-01 12 3.5557317E+00 2.2069929E-03 3.8891912E-01 13 1.8463768E+00 1.1572026E-04 2.2758839E-01 14 8.8758782E-01 -7.3771845E-05 6.2494861E-02 15 3.7354701E-01 1.7457000E-05 4.7322944E-03 16 2.1624908E-01 -1.1417494E-05 3.0997380E-04 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2719640E+07 -1.5592862E-03 7.2848026E-04 -3.6248985E-04 -1.9544979E-04 1.0595536E-04 -5.2952031E-05 -1.9740568E-05 2 1.4018117E+07 -4.9932721E-03 2.3333288E-03 -1.1611106E-03 -6.2606160E-04 3.3939309E-04 -1.6961426E-04 -6.3232526E-05 3 4.7691592E+06 -8.8196616E-03 4.1271865E-03 -2.0543318E-03 -1.1077631E-03 6.0054692E-04 -3.0013048E-04 -1.1188900E-04 4 1.7943097E+06 -1.4697882E-02 6.8872384E-03 -3.4290993E-03 -1.8492072E-03 1.0025081E-03 -5.0101663E-04 -1.8678079E-04 5 7.3981554E+05 -2.2009799E-02 1.0333980E-02 -5.1473683E-03 -2.7761508E-03 1.5051188E-03 -7.5221459E-04 -2.8042672E-04 6 3.2295501E+05 -3.2293375E-02 1.5199782E-02 -7.5752490E-03 -4.0861589E-03 2.2153733E-03 -1.1071846E-03 -4.1276584E-04 7 1.4881309E+05 -4.4665480E-02 2.1102376E-02 -1.0526557E-02 -5.6796293E-03 3.0796928E-03 -1.5392006E-03 -5.7381750E-04 8 7.1367052E+04 -6.0136957E-02 2.8572426E-02 -1.4273313E-02 -7.7040515E-03 4.1775796E-03 -2.0879493E-03 -7.7841665E-04 9 3.5520681E+04 -7.6379286E-02 3.6610631E-02 -1.8332338E-02 -9.9017937E-03 5.3710106E-03 -2.6846506E-03 -1.0008518E-03 10 1.8216486E+04 -9.1658123E-02 4.4519660E-02 -2.2375476E-02 -1.2097365E-02 6.5628408E-03 -3.2805416E-03 -1.2230928E-03 11 9.6229816E+03 -9.8921758E-02 4.8835794E-02 -2.4665653E-02 -1.3354938E-02 7.2501676E-03 -3.6247870E-03 -1.3513518E-03 12 5.2295339E+03 -9.2817306E-02 4.6016509E-02 -2.3279537E-02 -1.2606723E-02 6.8408805E-03 -3.4198212E-03 -1.2751603E-03 13 2.9214734E+03 -6.9327073E-02 3.0777347E-02 -1.4939458E-02 -7.9873830E-03 4.3223881E-03 -2.1588677E-03 -8.0442005E-04 14 1.6736199E+03 -3.7199284E-02 2.9130673E-03 1.8079438E-03 1.5570512E-03 -9.5258732E-04 4.9181063E-04 1.8401336E-04 15 9.8820875E+02 -1.1589285E-02 -3.0082748E-02 2.4999636E-02 1.5372444E-02 -8.6525736E-03 4.3718972E-03 1.6346195E-03 16 5.9356725E+02 -2.0616522E-03 -5.0284417E-02 4.5431302E-02 2.8900325E-02 -1.6498408E-02 8.3693139E-03 3.1281318E-03 17 3.6125652E+02 1.4203408E-04 -4.3264519E-02 4.5073270E-02 2.9928249E-02 -1.7241687E-02 8.7711531E-03 3.2849937E-03 18 2.2223702E+02 -2.1365859E-04 -1.9255791E-02 1.5793596E-02 1.0115735E-02 -5.9553036E-03 3.0538105E-03 1.1398755E-03 19 1.3980540E+02 2.0048878E-04 -3.8066262E-03 -2.3258128E-02 -2.5745379E-02 1.7519993E-02 -9.3606693E-03 -3.5313731E-03 20 8.8585590E+01 -1.8039812E-04 -2.9382073E-04 -3.4689533E-02 -4.5827776E-02 3.2638962E-02 -1.7639605E-02 -6.6960435E-03 21 5.6149197E+01 1.6828754E-04 -2.0601692E-05 -1.7836017E-02 -2.4018284E-02 1.7492589E-02 -9.6191193E-03 -3.6428056E-03 22 3.5546788E+01 -1.7810795E-04 3.0225157E-05 -3.5971741E-03 9.4995001E-03 -1.0490199E-02 6.0676592E-03 2.2960347E-03 23 2.4318016E+01 1.7617080E-04 -3.2624046E-05 -1.5924335E-04 2.1892273E-02 -3.0499570E-02 2.1044461E-02 8.4597351E-03 24 1.6404019E+01 -1.4022555E-04 3.3356335E-05 -9.3768538E-05 1.2907878E-02 -2.1284103E-02 1.4443459E-02 5.6471911E-03 25 1.1201716E+01 9.2325188E-05 -2.4697068E-05 3.6938320E-05 3.2069284E-03 2.3472789E-03 -3.3853649E-03 -1.3802053E-03 26 7.2464938E+00 -4.9920736E-05 1.4635623E-05 -1.3980561E-05 4.3200841E-04 1.4008437E-02 -1.5927157E-02 -7.0890621E-03 27 4.6003323E+00 2.6088792E-05 -8.4696775E-06 8.5770702E-06 -2.1320778E-05 9.3057168E-03 -1.2336750E-02 -5.8895978E-03 28 2.5948426E+00 -1.7554474E-05 6.1478424E-06 -4.9546719E-06 1.7981185E-05 1.6206376E-03 1.1830922E-03 8.0022755E-04 29 1.7184194E+00 1.5079016E-05 -5.5168097E-06 4.0910991E-06 -1.1913241E-05 -1.9122544E-04 6.1902711E-03 4.4941132E-03 30 1.0873304E+00 -1.0437119E-05 3.9787059E-06 -2.8214899E-06 5.7526821E-06 1.0315458E-04 3.3482440E-03 2.7146493E-03 31 7.3659376E-01 6.0087107E-06 -2.3522461E-06 1.5824923E-06 -2.6604852E-06 -4.1043331E-05 1.0633158E-03 1.3130009E-03 32 4.7125807E-01 -1.9403686E-06 7.7931608E-07 -5.0704276E-07 5.8691021E-07 9.5124169E-06 2.6189735E-04 -8.2866194E-04 33 2.2988689E-01 3.8821518E-07 -1.6062719E-07 9.9299678E-08 -6.1286548E-08 -1.2358859E-06 1.3610441E-05 -1.9102862E-03 34 1.1152686E-01 -1.1443338E-07 4.8323562E-08 -2.8902998E-08 5.5662010E-09 2.2683425E-07 5.7554168E-08 -1.0347407E-03 35 5.0196440E-02 2.4619027E-08 -1.0552895E-08 6.1754984E-09 9.1323981E-10 -2.9429161E-08 -4.6905703E-09 -1.2071503E-04 2p- 3p- 4p- 5p- 6p- 7p- 1 8.7882223E+07 -3.2548676E-05 1.7182551E-05 -9.3027655E-06 4.9666641E-06 2.3709416E-06 6.8000919E-07 2 3.7925146E+07 -1.4295360E-04 7.5498001E-05 -4.0878555E-05 2.1821695E-05 1.0415094E-05 2.9871585E-06 3 1.6097922E+07 -3.2513260E-04 1.7179430E-04 -9.3031905E-05 4.9670458E-05 2.3710674E-05 6.8004765E-06 4 7.0050657E+06 -5.9699611E-04 3.1570456E-04 -1.7099655E-04 9.1290008E-05 4.3572261E-05 1.2497041E-05 5 3.1199170E+06 -1.0028815E-03 5.3087110E-04 -2.8761820E-04 1.5358410E-04 7.3318484E-05 2.1028665E-05 6 1.4185524E+06 -1.6067273E-03 8.5181715E-04 -4.6167119E-04 2.4651493E-04 1.1766419E-04 3.3747791E-05 7 6.5664636E+05 -2.5100196E-03 1.3332157E-03 -7.2295199E-04 3.8615221E-04 1.8435976E-04 5.2877334E-05 8 3.0901950E+05 -3.8647509E-03 2.0584292E-03 -1.1169525E-03 5.9660139E-04 2.8478335E-04 8.1681330E-05 9 1.4768105E+05 -5.9096326E-03 3.1582358E-03 -1.7152770E-03 9.1662407E-04 4.3768903E-04 1.2553891E-04 10 7.1613099E+04 -9.0082170E-03 4.8367698E-03 -2.6299263E-03 1.4055276E-03 6.7100629E-04 1.9246296E-04 11 3.5229671E+04 -1.3679514E-02 7.3873917E-03 -4.0228732E-03 2.1514980E-03 1.0275962E-03 2.9474806E-04 12 1.7604081E+04 -2.0555681E-02 1.1188372E-02 -6.1046244E-03 3.2656914E-03 1.5594203E-03 4.4730594E-04 13 8.9556177E+03 -3.0165742E-02 1.6584979E-02 -9.0730579E-03 4.8591227E-03 2.3217914E-03 6.6600735E-04 14 4.6486654E+03 -4.2246233E-02 2.3548405E-02 -1.2927313E-02 6.9273107E-03 3.3092271E-03 9.4930363E-04 15 2.4651972E+03 -5.4306508E-02 3.0727479E-02 -1.6933939E-02 9.0895255E-03 4.3463518E-03 1.2468783E-03 16 1.3352849E+03 -6.0223179E-02 3.4261407E-02 -1.8890112E-02 1.0131831E-02 4.8400561E-03 1.3885239E-03 17 7.3853195E+02 -5.2102650E-02 2.7304874E-02 -1.4549805E-02 7.7273862E-03 3.6865088E-03 1.0569625E-03 18 4.1658693E+02 -2.9788417E-02 4.4053661E-03 6.1268750E-04 -8.9352343E-04 -5.1086588E-04 -1.5033089E-04 19 2.3886203E+02 -8.2606672E-03 -2.5992442E-02 2.2702223E-02 -1.3739847E-02 -6.7734402E-03 -1.9543309E-03 20 1.3924505E+02 3.1918926E-04 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33 8.1358919E-02 2.9996699E-09 -5.4578459E-10 -1.8707747E-08 1.5864046E-08 -1.8231427E-06 -9.1483414E-04 34 3.8116773E-02 -1.3974769E-09 1.5666314E-09 3.6452830E-09 3.1892258E-09 -2.6237819E-07 -6.6559014E-04 35 1.7566317E-02 4.3271081E-10 -7.4911216E-10 -2.2137810E-10 3.5959634E-10 -5.3169993E-08 -1.5321920E-04 3d- 4d- 5d- 6d- 1 1.1671412E+06 -3.4157135E-06 2.0701393E-06 -1.0705034E-06 3.8433202E-07 2 2.6691682E+05 -1.6021467E-05 9.7035786E-06 -5.0114901E-06 1.7988321E-06 3 8.2116423E+04 -5.9864544E-05 3.6363628E-05 -1.8814306E-05 6.7555364E-06 4 2.9783340E+04 -1.9871378E-04 1.2074920E-04 -6.2425352E-05 2.2411907E-05 5 1.2124264E+04 -5.9926744E-04 3.6541379E-04 -1.8923591E-04 6.7961973E-05 6 5.3960761E+03 -1.6539590E-03 1.0108526E-03 -5.2346629E-04 1.8800239E-04 7 2.5813010E+03 -4.1333820E-03 2.5415986E-03 -1.3191368E-03 4.7398782E-04 8 1.3086162E+03 -9.1871590E-03 5.6882091E-03 -2.9561725E-03 1.0625400E-03 9 6.9434397E+02 -1.7794437E-02 1.1166412E-02 -5.8284220E-03 2.0968800E-03 10 3.8229501E+02 -2.8870916E-02 1.8283274E-02 -9.5586316E-03 3.4401189E-03 11 2.1624254E+02 -3.6675865E-02 2.2973868E-02 -1.1988811E-02 4.3130941E-03 12 1.2498461E+02 -3.3489597E-02 1.8581441E-02 -9.2261944E-03 3.2781792E-03 13 7.3145142E+01 -1.9098549E-02 1.1266490E-03 1.5797451E-03 -7.5373308E-04 14 4.3011978E+01 -5.7387879E-03 -1.7351501E-02 1.3195985E-02 -5.1152077E-03 15 2.5495125E+01 -6.2603878E-04 -2.1480970E-02 1.5746147E-02 -6.0738201E-03 16 1.5154401E+01 1.2279858E-05 -1.1052266E-02 2.8589146E-03 -4.2625024E-04 17 8.9264900E+00 2.9440440E-05 -2.3716676E-03 -1.0397902E-02 5.4146073E-03 18 5.1621578E+00 1.2587643E-05 -1.5569994E-04 -1.0870550E-02 5.4874207E-03 19 2.9319801E+00 7.2655790E-06 -2.1752999E-06 -4.3610262E-03 5.8207300E-04 20 1.6103860E+00 3.0890775E-06 2.6005576E-06 -6.5450597E-04 -3.5518887E-03 21 8.5312386E-01 1.5723380E-06 8.1481286E-07 -2.6199955E-05 -3.7987991E-03 22 4.3318267E-01 7.3444729E-07 5.5336495E-07 -1.3319587E-06 -2.0924878E-03 23 2.0988029E-01 2.5663798E-07 1.4710912E-07 3.8719681E-07 -6.2597392E-04 24 9.3438434E-02 1.8668201E-07 1.2409134E-07 8.2882504E-08 -5.8171296E-05 3d+ 4d+ 5d+ 6d+ 1 1.1671412E+06 -2.7768823E-07 1.7029116E-07 -8.7887024E-08 2.9878327E-08 2 2.6691682E+05 -2.5073300E-06 1.5234082E-06 -7.8211636E-07 2.6619040E-07 3 8.2116423E+04 -1.5300140E-05 9.3451291E-06 -4.8115247E-06 1.6366609E-06 4 2.9783340E+04 -7.3220037E-05 4.4628950E-05 -2.2946663E-05 7.8082789E-06 5 1.2124264E+04 -2.8931966E-04 1.7690005E-04 -9.1079300E-05 3.0988751E-05 6 5.3960761E+03 -9.7481363E-04 5.9694828E-04 -3.0736964E-04 1.0461002E-04 7 2.5813010E+03 -2.8286656E-03 1.7422049E-03 -8.9871794E-04 3.0592714E-04 8 1.3086162E+03 -7.0440320E-03 4.3691139E-03 -2.2576540E-03 7.6892436E-04 9 6.9434397E+02 -1.4874188E-02 9.3566006E-03 -4.8549355E-03 1.6547605E-03 10 3.8229501E+02 -2.5886422E-02 1.6498066E-02 -8.5880252E-03 2.9295490E-03 11 2.1624254E+02 -3.5170604E-02 2.2366704E-02 -1.1645672E-02 3.9723092E-03 12 1.2498461E+02 -3.4590012E-02 2.0332916E-02 -1.0278133E-02 3.4819231E-03 13 7.3145142E+01 -2.1488657E-02 4.7956921E-03 -7.3991868E-04 1.1308945E-04 14 4.3011978E+01 -7.2522033E-03 -1.4495610E-02 1.1228553E-02 -4.1276051E-03 15 2.5495125E+01 -1.0099072E-03 -2.1576950E-02 1.6003031E-02 -5.8648344E-03 16 1.5154401E+01 -5.2743007E-05 -1.2480383E-02 5.1832991E-03 -1.4123435E-03 17 8.9264900E+00 5.2603551E-06 -3.0438853E-03 -8.7859246E-03 4.3441583E-03 18 5.1621578E+00 4.4046836E-07 -2.5065569E-04 -1.1126783E-02 5.3473253E-03 19 2.9319801E+00 1.0953986E-06 -1.0583679E-05 -5.0797025E-03 1.3690117E-03 20 1.6103860E+00 -1.6818297E-07 1.5594691E-08 -8.8332671E-04 -2.8087627E-03 21 8.5312386E-01 8.5055686E-08 -6.0104084E-08 -4.5196415E-05 -3.6525589E-03 22 4.3318267E-01 -2.4759927E-08 5.4263944E-08 -3.1139887E-06 -2.3030928E-03 23 2.0988029E-01 5.9128003E-09 -1.0333320E-08 2.6490075E-07 -8.3422631E-04 24 9.3438434E-02 -7.4789263E-10 7.9444761E-10 -3.6676767E-08 -1.1480500E-04 4f- 5f- 1 6.6678464E+03 -3.3500500E-05 1.6302371E-05 2 2.1345513E+03 -2.2376136E-04 1.0982641E-04 3 8.8310589E+02 -9.7788383E-04 4.7886467E-04 4 4.1621459E+02 -3.2300485E-03 1.5936214E-03 5 2.1293537E+02 -8.0112072E-03 3.9521912E-03 6 1.1439928E+02 -1.5266177E-02 7.5907439E-03 7 6.3659645E+01 -2.1611707E-02 1.0395884E-02 8 3.5985904E+01 -2.1766933E-02 9.5029267E-03 9 2.0594089E+01 -1.4389555E-02 3.0462337E-03 10 1.1743615E+01 -5.3725226E-03 -6.2627322E-03 11 6.5450100E+00 -8.8304919E-04 -1.0410476E-02 12 3.5557317E+00 -3.4150712E-05 -7.8857960E-03 13 1.8463768E+00 -2.8922612E-07 -3.1771747E-03 14 8.8758782E-01 9.7276111E-07 -5.5757970E-04 15 3.7354701E-01 -2.4932391E-08 -2.3146781E-05 16 2.1624908E-01 6.9993317E-08 -1.2897963E-06 4f+ 5f+ 1 6.6678464E+03 -2.0923270E-05 1.0087178E-05 2 2.1345513E+03 -1.6804326E-04 8.1890798E-05 3 8.8310589E+02 -8.1372224E-04 3.9539647E-04 4 4.1621459E+02 -2.8461937E-03 1.3939015E-03 5 2.1293537E+02 -7.3884687E-03 3.6188962E-03 6 1.1439928E+02 -1.4531121E-02 7.1781852E-03 7 6.3659645E+01 -2.1030108E-02 1.0100759E-02 8 3.5985904E+01 -2.1791967E-02 9.5729381E-03 9 2.0594089E+01 -1.4854310E-02 3.5754998E-03 10 1.1743615E+01 -5.7431453E-03 -5.6088472E-03 11 6.5450100E+00 -1.0012082E-03 -1.0184242E-02 12 3.5557317E+00 -4.5483296E-05 -8.0269943E-03 13 1.8463768E+00 -1.7737603E-06 -3.3851783E-03 14 8.8758782E-01 7.8294791E-07 -6.4453216E-04 15 3.7354701E-01 -1.2787051E-07 -3.1655736E-05 16 2.1624908E-01 6.3341435E-08 -1.5805402E-06 ** Uuq 289 ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2603380E+07 1.7819401E-03 -8.4101132E-04 4.1902582E-04 2.2626025E-04 -1.2307304E-04 6.2086123E-05 2.4101457E-05 2 1.3986165E+07 3.9190058E-03 -1.8618733E-03 9.2880063E-04 5.0168363E-04 -2.7291513E-04 1.3768041E-04 5.3447117E-05 3 4.7561904E+06 7.0649103E-03 -3.3814137E-03 1.6891543E-03 9.1270961E-04 -4.9656388E-04 2.5051404E-04 9.7249161E-05 4 1.7878194E+06 1.1501401E-02 -5.5681756E-03 2.7873556E-03 1.5069320E-03 -8.1999396E-04 4.1370470E-04 1.6060200E-04 5 7.3627109E+05 1.8261901E-02 -8.9580857E-03 4.4950471E-03 2.4316684E-03 -1.3234157E-03 6.6772250E-04 2.5921361E-04 6 3.2094051E+05 2.8081600E-02 -1.4022447E-02 7.0585112E-03 3.8215698E-03 -2.0804168E-03 1.0497536E-03 4.0753260E-04 7 1.4766063E+05 4.2708255E-02 -2.1746100E-02 1.0984514E-02 5.9524529E-03 -3.2411858E-03 1.6355516E-03 6.3494401E-04 8 7.0743176E+04 6.3655094E-02 -3.3179819E-02 1.6827903E-02 9.1286982E-03 -4.9725991E-03 2.5095865E-03 9.7431932E-04 9 3.5263194E+04 9.2548043E-02 -4.9404836E-02 2.5166583E-02 1.3667284E-02 -7.4464642E-03 3.7581876E-03 1.4589897E-03 10 1.8190667E+04 1.2848597E-01 -7.0412098E-02 3.6031042E-02 1.9592034E-02 -1.0680850E-02 5.3919137E-03 2.0935933E-03 11 9.7321519E+03 1.6403397E-01 -9.1765144E-02 4.7147183E-02 2.5659171E-02 -1.3985514E-02 7.0585790E-03 2.7398928E-03 12 5.4211986E+03 1.8148174E-01 -1.0169789E-01 5.2014553E-02 2.8276486E-02 -1.5425840E-02 7.7909601E-03 3.0267050E-03 13 3.1880044E+03 1.6096998E-01 -7.9800606E-02 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3.9928796E-07 -8.9289368E-05 1.2678493E-01 3d- 4d- 5d- 6d- 1 1.2458824E+06 9.0820766E-06 -5.5114101E-06 2.8651147E-06 -1.0669643E-06 2 2.8490663E+05 3.8707313E-05 -2.3492547E-05 1.2212205E-05 -4.5478463E-06 3 8.7802543E+04 1.3625421E-04 -8.2770088E-05 4.3041676E-05 -1.6029681E-05 4 3.1870538E+04 4.3217941E-04 -2.6278960E-04 1.3667085E-04 -5.0902248E-05 5 1.2969100E+04 1.3051597E-03 -7.9581819E-04 4.1428067E-04 -1.5432319E-04 6 5.7636960E+03 3.8603120E-03 -2.3614462E-03 1.2301067E-03 -4.5831537E-04 7 2.7508794E+03 1.1122329E-02 -6.8466004E-03 3.5736039E-03 -1.3319850E-03 8 1.3906289E+03 3.0223017E-02 -1.8741856E-02 9.7992422E-03 -3.6540955E-03 9 7.3554061E+02 7.4443169E-02 -4.6777240E-02 2.4556954E-02 -9.1650138E-03 10 4.0377943E+02 1.5692426E-01 -9.9520794E-02 5.2347558E-02 -1.9546378E-02 11 2.2793463E+02 2.6166138E-01 -1.6425232E-01 8.6216962E-02 -3.2176450E-02 12 1.3161684E+02 3.1585564E-01 -1.7751535E-01 8.9144416E-02 -3.2901264E-02 13 7.7111759E+01 2.4101459E-01 -2.6761785E-02 -1.1277769E-02 6.5174460E-03 14 4.5482552E+01 9.9969629E-02 2.5791979E-01 -1.9925635E-01 8.0332242E-02 15 2.7017663E+01 1.7018137E-02 4.3914447E-01 -3.2642040E-01 1.3116457E-01 16 1.6116946E+01 1.0020394E-03 3.0887029E-01 -1.0274870E-01 2.3796333E-02 17 9.5374137E+00 -1.5920032E-04 9.3103825E-02 3.3765534E-01 -1.8526094E-01 18 5.5384663E+00 -2.7307052E-05 9.2588751E-03 5.0177291E-01 -2.6611922E-01 19 3.1655710E+00 -4.9898635E-05 4.4146770E-04 2.8200348E-01 -5.6635279E-02 20 1.7569544E+00 9.9637622E-06 -4.2392017E-05 6.1364131E-02 2.8402264E-01 21 9.4241219E-01 -7.7867836E-06 2.2228634E-05 3.7716733E-03 4.3577975E-01 22 4.8606519E-01 3.2490945E-06 -1.1227541E-05 2.6442862E-04 3.3448731E-01 23 2.3901036E-01 -1.3063275E-06 5.3911339E-06 -7.1040485E-05 1.3592943E-01 24 1.0633467E-01 3.1631990E-07 -9.9246061E-07 5.5671458E-06 1.6996761E-02 3d+ 4d+ 5d+ 6d+ 1 1.2458824E+06 1.5562668E-07 -9.5431237E-08 4.9440934E-08 -1.7585100E-08 2 2.8490663E+05 1.6128558E-06 -9.8714920E-07 5.1123842E-07 -1.8202773E-07 3 8.7802543E+04 1.1755477E-05 -7.2186766E-06 3.7415137E-06 -1.3313941E-06 4 3.1870538E+04 7.0096802E-05 -4.3048646E-05 2.2314482E-05 -7.9448847E-06 5 1.2969100E+04 3.5719233E-04 -2.2003724E-04 1.1414830E-04 -4.0632620E-05 6 5.7636960E+03 1.5866370E-03 -9.7950750E-04 5.0845134E-04 -1.8106952E-04 7 2.7508794E+03 6.1422436E-03 -3.8126329E-03 1.9820252E-03 -7.0589524E-04 8 1.3906289E+03 2.0512641E-02 -1.2819306E-02 6.6767211E-03 -2.3793807E-03 9 7.3554061E+02 5.8055854E-02 -3.6766217E-02 1.9220417E-02 -6.8538975E-03 10 4.0377943E+02 1.3500567E-01 -8.6620398E-02 4.5439453E-02 -1.6218652E-02 11 2.2793463E+02 2.4449721E-01 -1.5660323E-01 8.2147419E-02 -2.9314954E-02 12 1.3161684E+02 3.2006570E-01 -1.9105238E-01 9.7676514E-02 -3.4650907E-02 13 7.7111759E+01 2.6605551E-01 -7.0557390E-02 1.6838931E-02 -4.2862600E-03 14 4.5482552E+01 1.2240377E-01 2.1017192E-01 -1.6639030E-01 6.4201097E-02 15 2.7017663E+01 2.4041959E-02 4.3675000E-01 -3.2815981E-01 1.2625740E-01 16 1.6116946E+01 1.6436890E-03 3.4603978E-01 -1.6351052E-01 5.0327305E-02 17 9.5374137E+00 -1.2359139E-04 1.1801042E-01 2.7744695E-01 -1.4654976E-01 18 5.5384663E+00 -5.0735675E-05 1.4094874E-02 5.0908515E-01 -2.5859493E-01 19 3.1655710E+00 -5.6327785E-05 7.2848465E-04 3.2619965E-01 -1.0524292E-01 20 1.7569544E+00 7.6152310E-06 1.7302026E-05 8.2003541E-02 2.2209196E-01 21 9.4241219E-01 -7.3548084E-06 1.7383096E-06 6.3351571E-03 4.2068958E-01 22 4.8606519E-01 3.1865479E-06 -7.7074536E-06 4.9309513E-04 3.6955182E-01 23 2.3901036E-01 -1.2407827E-06 2.7787332E-06 -6.4448894E-05 1.7975254E-01 24 1.0633467E-01 2.9981790E-07 -2.9836786E-07 2.8198933E-06 3.2725823E-02 4f- 5f- 1 6.9737416E+03 7.8899763E-05 -3.9033926E-05 2 2.2290073E+03 6.0946335E-04 -3.0331880E-04 3 9.2124970E+02 3.4431899E-03 -1.7115221E-03 4 4.3389933E+02 1.5221130E-02 -7.6210531E-03 5 2.2194091E+02 5.0826000E-02 -2.5447330E-02 6 1.1925774E+02 1.3017949E-01 -6.5700080E-02 7 6.6405441E+01 2.4669039E-01 -1.2057636E-01 8 3.7580921E+01 3.3202930E-01 -1.4769097E-01 9 2.1544229E+01 2.9349039E-01 -6.6444750E-02 10 1.2321911E+01 1.4791401E-01 1.6196662E-01 11 6.9047998E+00 3.3837670E-02 3.6943150E-01 12 3.7888954E+00 2.0662133E-03 3.8160406E-01 13 2.0031370E+00 9.2970060E-05 2.1533187E-01 14 9.9243102E-01 -6.4652436E-05 5.6687195E-02 15 4.2886320E-01 6.2084807E-06 4.2366310E-03 16 1.6496259E-01 -3.6764318E-06 6.0396707E-05 4f+ 5f+ 1 6.9737416E+03 2.9331362E-05 -1.4389874E-05 2 2.2290073E+03 3.6413047E-04 -1.8034182E-04 3 9.2124970E+02 2.5792495E-03 -1.2740467E-03 4 4.3389933E+02 1.2742820E-02 -6.3432552E-03 5 2.2194091E+02 4.5705982E-02 -2.2752665E-02 6 1.1925774E+02 1.2224896E-01 -6.1378028E-02 7 6.6405441E+01 2.3811766E-01 -1.1638976E-01 8 3.7580921E+01 3.3080482E-01 -1.4826613E-01 9 2.1544229E+01 3.0187571E-01 -7.7094600E-02 10 1.2321911E+01 1.5752530E-01 1.4399756E-01 11 6.9047998E+00 3.8017993E-02 3.6079856E-01 12 3.7888954E+00 2.5461887E-03 3.8813810E-01 13 2.0031370E+00 1.2689520E-04 2.2913240E-01 14 9.9243102E-01 -7.4082009E-05 6.5262048E-02 15 4.2886320E-01 8.0799793E-06 5.5939119E-03 16 1.6496259E-01 -4.6755868E-06 7.3492831E-05 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2603380E+07 -1.6486048E-03 7.7505193E-04 -3.8588165E-04 -2.0832358E-04 1.1330956E-04 -5.7159692E-05 -2.2188911E-05 2 1.3986165E+07 -5.2691398E-03 2.4777387E-03 -1.2336583E-03 -6.6601639E-04 3.6225893E-04 -1.8274508E-04 -7.0940600E-05 3 4.7561904E+06 -9.2867316E-03 4.3731866E-03 -2.1780327E-03 -1.1759420E-03 6.3962205E-04 -3.2266278E-04 -1.2525483E-04 4 1.7878194E+06 -1.5438640E-02 7.2801256E-03 -3.6267437E-03 -1.9582639E-03 1.0651921E-03 -5.3735614E-04 -2.0860022E-04 5 7.3627109E+05 -2.3054336E-02 1.0892562E-02 -5.4287951E-03 -2.9316051E-03 1.5946400E-03 -8.0443733E-04 -3.1227426E-04 6 3.2094051E+05 -3.3727504E-02 1.5974129E-02 -7.9654848E-03 -4.3021103E-03 2.3403441E-03 -1.1806698E-03 -4.5834003E-04 7 1.4766063E+05 -4.6468989E-02 2.2088132E-02 -1.1024809E-02 -5.9558554E-03 3.2399866E-03 -1.6344874E-03 -6.3448599E-04 8 7.0743176E+04 -6.2190637E-02 2.9721732E-02 -1.4854416E-02 -8.0279035E-03 4.3681747E-03 -2.2038565E-03 -8.5557588E-04 9 3.5263194E+04 -7.8042534E-02 3.7603519E-02 -1.8839771E-02 -1.0188096E-02 5.5437163E-03 -2.7968045E-03 -1.0856584E-03 10 1.8190667E+04 -9.2162686E-02 4.4950483E-02 -2.2593893E-02 -1.2230509E-02 6.6589847E-03 -3.3603667E-03 -1.3046975E-03 11 9.7321519E+03 -9.7020844E-02 4.7943170E-02 -2.4213993E-02 -1.3122413E-02 7.1431085E-03 -3.6037619E-03 -1.3987026E-03 12 5.4211986E+03 -8.8320614E-02 4.3666114E-02 -2.2036127E-02 -1.1943960E-02 6.5106738E-03 -3.2875753E-03 -1.2771590E-03 13 3.1880044E+03 -6.3169331E-02 2.8220949E-02 -1.3799783E-02 -7.3908934E-03 3.9934776E-03 -2.0077536E-03 -7.7712938E-04 14 2.0150863E+03 -3.6001188E-02 9.4417913E-03 -2.9391633E-03 -1.3024126E-03 6.9577118E-04 -3.5546271E-04 -1.4218328E-04 15 1.3642452E+03 -1.7477157E-02 -1.0750147E-02 9.7300201E-03 6.0891650E-03 -3.5164584E-03 1.8147201E-03 7.1388434E-04 16 8.8552043E+02 -7.9157875E-03 -3.1771247E-02 2.7111437E-02 1.6794313E-02 -9.4464532E-03 4.7996955E-03 1.8585965E-03 17 5.7259620E+02 -5.5206669E-04 -4.6222808E-02 4.1874469E-02 2.6810850E-02 -1.5450039E-02 7.9416892E-03 3.1041269E-03 18 3.6218995E+02 -4.6327134E-04 -4.0384461E-02 4.3141589E-02 2.8788974E-02 -1.6605384E-02 8.5054306E-03 3.3031348E-03 19 2.2469725E+02 2.3508631E-04 -1.9210597E-02 1.2817277E-02 7.5482623E-03 -4.4097073E-03 2.2963464E-03 9.0808046E-04 20 1.3283457E+02 -1.6579537E-04 -3.4156050E-03 -2.9890296E-02 -3.4164686E-02 2.3616948E-02 -1.2816061E-02 -5.0683676E-03 21 8.2014084E+01 1.4883654E-04 4.1330902E-05 -3.4402142E-02 -4.7039682E-02 3.3853858E-02 -1.8466737E-02 -7.2681447E-03 22 5.0807501E+01 -1.4480577E-04 -9.2158265E-05 -1.3159331E-02 -1.5089993E-02 1.0933174E-02 -6.3070543E-03 -2.5643286E-03 23 3.3163111E+01 1.4632455E-04 5.6293335E-05 -1.6445742E-03 1.6382551E-02 -1.8549927E-02 1.1684445E-02 4.8277035E-03 24 2.2648064E+01 -1.1789877E-04 -2.3038786E-05 -3.0415207E-04 2.1092002E-02 -3.1991593E-02 2.2496026E-02 9.3085727E-03 25 1.4901811E+01 7.0250444E-05 6.1683620E-06 5.0399190E-05 1.0446314E-02 -1.5218419E-02 1.0067107E-02 4.2066395E-03 26 9.3244437E+00 -3.7690817E-05 5.3628445E-07 -2.0832084E-05 1.3761214E-03 1.2170823E-02 -1.3247901E-02 -5.9937541E-03 27 5.6332915E+00 2.1346428E-05 -2.4158524E-06 1.2096566E-05 7.4491184E-05 1.4313502E-02 -1.8371418E-02 -8.9221669E-03 28 3.1475933E+00 -1.8434379E-05 3.4752391E-06 -7.0995768E-06 -1.6189033E-05 3.2290242E-03 -3.3791194E-03 -1.9357371E-03 29 2.1911636E+00 1.5820031E-05 -3.6229181E-06 5.3109474E-06 1.3878050E-05 -2.5777752E-04 6.5121103E-03 4.7230613E-03 30 1.3604416E+00 -8.3323600E-06 2.2867939E-06 -2.4139246E-06 -6.7167605E-06 1.3689126E-04 5.0968630E-03 4.1352086E-03 31 8.4572106E-01 4.2228652E-06 -1.3091611E-06 1.0120850E-06 2.5695514E-06 -3.8684195E-05 1.8199496E-03 2.1874259E-03 32 5.2443017E-01 -1.5915258E-06 5.4050205E-07 -3.3044721E-07 -8.0108019E-07 9.7461207E-06 2.9385181E-04 -9.4271487E-04 33 2.5694204E-01 3.9429421E-07 -1.4689126E-07 6.5833205E-08 1.3173040E-07 -1.5322058E-06 1.9394773E-05 -2.1591251E-03 34 1.2561942E-01 -1.2427994E-07 4.9166438E-08 -1.7157316E-08 -2.5675643E-08 2.8971041E-07 -9.4600151E-07 -1.0718598E-03 35 5.5523221E-02 2.6670717E-08 -1.1027616E-08 3.1380321E-09 3.1765225E-09 -3.5528131E-08 6.2906538E-08 -1.1301538E-04 2p- 3p- 4p- 5p- 6p- 7p- 1 8.7168681E+07 -3.6223602E-05 1.9126843E-05 -1.0368561E-05 -5.5566449E-06 -2.6853151E-06 8.5579374E-07 2 3.7453243E+07 -1.5834121E-04 8.3641424E-05 -4.5347584E-05 -2.4300291E-05 -1.1741921E-05 3.7420646E-06 3 1.5852709E+07 -3.5870939E-04 1.8958135E-04 -1.0279613E-04 -5.5092254E-05 -2.6623748E-05 8.4848479E-06 4 6.8887365E+06 -6.5599595E-04 3.4698747E-04 -1.8819031E-04 -1.0085525E-04 -4.8734707E-05 1.5531475E-05 5 3.0664598E+06 -1.0980907E-03 5.8143867E-04 -3.1542303E-04 -1.6907197E-04 -8.1709243E-05 2.6040500E-05 6 1.3936076E+06 -1.7543046E-03 9.3033342E-04 -5.0490708E-04 -2.7063977E-04 -1.3078223E-04 4.1679943E-05 7 6.4459264E+05 -2.7331120E-03 1.4522611E-03 -7.8853874E-04 -4.2278671E-04 -2.0434301E-04 6.5124436E-05 8 3.0310118E+05 -4.1923353E-03 2.2338079E-03 -1.2137992E-03 -6.5083810E-04 -3.1453136E-04 1.0024200E-04 9 1.4483877E+05 -6.3749441E-03 3.4086761E-03 -1.8537754E-03 -9.9441147E-04 -4.8069593E-04 1.5320230E-04 10 7.0316897E+04 -9.6482016E-03 5.1832870E-03 -2.8223950E-03 -1.5142548E-03 -7.3190074E-04 2.3326571E-04 11 3.4670548E+04 -1.4539142E-02 7.8570303E-03 -4.2844973E-03 -2.3001731E-03 -1.1121713E-03 3.5447391E-04 12 1.7370584E+04 -2.1680537E-02 1.1808977E-02 -6.4528533E-03 -3.4654823E-03 -1.6754246E-03 5.3400517E-04 13 8.8579093E+03 -3.1568534E-02 1.7369948E-02 -9.5156094E-03 -5.1156010E-03 -2.4745076E-03 7.8873602E-04 14 4.6055784E+03 -4.3842295E-02 2.4451234E-02 -1.3442662E-02 -7.2317295E-03 -3.4977415E-03 1.1149263E-03 15 2.4436789E+03 -5.5794370E-02 3.1560517E-02 -1.7410432E-02 -9.3797801E-03 -4.5402336E-03 1.4473296E-03 16 1.3230504E+03 -6.0926862E-02 3.4519623E-02 -1.9033256E-02 -1.0244507E-02 -4.9546323E-03 1.5793569E-03 17 7.3153152E+02 -5.1323315E-02 2.6230350E-02 -1.3829397E-02 -7.3411650E-03 -3.5403933E-03 1.1276912E-03 18 4.1299565E+02 -2.8122652E-02 1.9322777E-03 2.3593439E-03 1.9083338E-03 1.0177856E-03 -3.2968956E-04 19 2.3736470E+02 -7.2225853E-03 -2.8114728E-02 2.4452391E-02 1.4865424E-02 7.4271503E-03 -2.3819856E-03 20 1.3897737E+02 5.3565739E-04 -3.9962915E-02 3.5357238E-02 2.1955355E-02 1.1065953E-02 -3.5529409E-03 21 8.2586205E+01 1.0959904E-03 -2.4366011E-02 1.6557492E-02 8.5978490E-03 4.0417571E-03 -1.2818326E-03 22 4.9065796E+01 7.9412589E-04 -6.2691168E-03 -1.5432411E-02 -1.5677201E-02 -8.8210468E-03 2.8912259E-03 23 2.9308796E+01 5.1654715E-04 -4.2627334E-04 -2.5516930E-02 -2.6682310E-02 -1.5808978E-02 5.2287707E-03 24 1.7748197E+01 3.5618767E-04 -1.7240567E-05 -1.1271497E-02 -7.2398871E-03 -2.8236880E-03 8.3782997E-04 25 1.0569152E+01 2.5240546E-04 3.1858676E-05 -1.6453711E-03 1.4238533E-02 1.2766000E-02 -4.5179052E-03 26 6.2187668E+00 1.6752523E-04 6.0757781E-06 1.2443777E-05 1.2262825E-02 1.1120159E-02 -4.0249545E-03 27 3.6509163E+00 1.1799103E-04 1.1313988E-05 1.3405414E-06 2.9819965E-03 -1.0494245E-03 7.0612958E-04 28 2.1274583E+00 7.3820324E-05 3.3281100E-06 2.3456935E-05 2.4050569E-04 -6.7897021E-03 3.4094931E-03 29 1.2356184E+00 5.6415217E-05 4.5064313E-06 6.1129159E-06 -2.7109875E-06 -4.1646585E-03 2.1629227E-03 30 7.1521558E-01 2.9775800E-05 1.6787409E-06 7.4787455E-06 3.7550411E-06 -1.1095062E-03 1.4243163E-04 31 4.0329089E-01 2.9907207E-05 2.1077387E-06 4.8364868E-06 -2.0535373E-06 -1.3425911E-04 -1.3028008E-03 32 2.0792017E-01 1.3113054E-05 8.5099986E-07 2.6391870E-06 4.9633074E-07 -1.0450515E-05 -1.6868765E-03 33 1.0170824E-01 1.5255075E-05 1.0281113E-06 2.7706128E-06 -1.1658748E-07 -8.2044305E-08 -9.7359891E-04 34 4.8219757E-02 1.3946310E-06 9.2707640E-08 2.7346020E-07 4.7630687E-08 -5.6299006E-08 -1.9373553E-04 35 2.2221568E-02 8.2921312E-06 5.5532520E-07 1.5364922E-06 2.4523975E-08 2.8279796E-07 -3.4848105E-06 2p+ 3p+ 4p+ 5p+ 6p+ 7p+ 1 8.7168681E+07 -1.6015197E-07 9.2099478E-08 -5.2263723E-08 2.8821873E-08 1.3175128E-08 3.3443400E-09 2 3.7453243E+07 -9.5692517E-07 5.4657623E-07 -3.0185015E-07 1.5854865E-07 6.9809906E-08 1.7571952E-08 3 1.5852709E+07 -2.7775793E-06 1.5927404E-06 -8.9369412E-07 4.8320226E-07 2.1763344E-07 5.5062645E-08 4 6.8887365E+06 -7.2265998E-06 4.1323858E-06 -2.2917080E-06 1.2130346E-06 5.3739416E-07 1.3545824E-07 5 3.0664598E+06 -1.7989900E-05 1.0310452E-05 -5.7685512E-06 3.1026095E-06 1.3917860E-06 3.5181289E-07 6 1.3936076E+06 -4.3782358E-05 2.5057268E-05 -1.3928594E-05 7.4033782E-06 3.2905800E-06 8.3005769E-07 7 6.4459264E+05 -1.0428358E-04 5.9770985E-05 -3.3389322E-05 1.7904975E-05 8.0132932E-06 2.0245265E-06 8 3.0310118E+05 -2.4333850E-04 1.3941425E-04 -7.7608462E-05 4.1346589E-05 1.8410247E-05 4.6459139E-06 9 1.4483877E+05 -5.5488395E-04 3.1837010E-04 -1.7775266E-04 9.5176552E-05 4.2544018E-05 1.0745608E-05 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1.2356184E+00 -1.5462337E-08 5.5954667E-07 -3.1952047E-06 -6.5756495E-05 4.8999032E-03 1.8181740E-03 30 7.1521558E-01 -2.4460764E-09 -2.5501664E-07 1.7202684E-06 -1.5631529E-06 2.6327578E-03 1.0558190E-03 31 4.0329089E-01 8.2099726E-09 6.9832640E-08 -5.4990429E-07 -1.8481430E-07 6.8744495E-04 2.0342529E-05 32 2.0792017E-01 -5.5569931E-09 -1.4429063E-08 1.6108078E-07 3.1661510E-07 6.6046952E-05 -8.1669821E-04 33 1.0170824E-01 3.1952344E-09 4.3058764E-10 -4.4669249E-08 -3.2795827E-08 2.8612014E-06 -1.0818697E-03 34 4.8219757E-02 -1.5556277E-09 1.6943569E-09 9.0769482E-09 2.7854598E-08 8.2817342E-07 -7.1781900E-04 35 2.2221568E-02 4.9254527E-10 -8.3705060E-10 -1.1225205E-09 -1.6578549E-09 1.0805305E-07 -1.5419744E-04 3d- 4d- 5d- 6d- 1 1.2458824E+06 -3.3682091E-06 2.0473917E-06 -1.0651513E-06 3.9669711E-07 2 2.8490663E+05 -1.5676506E-05 9.5240303E-06 -4.9508406E-06 1.8438345E-06 3 8.7802543E+04 -5.8089458E-05 3.5389775E-05 -1.8422010E-05 6.8619162E-06 4 3.1870538E+04 -1.9162214E-04 1.1679483E-04 -6.0771211E-05 2.2637367E-05 5 1.2969100E+04 -5.7586496E-04 3.5217244E-04 -1.8349869E-04 6.8366620E-05 6 5.7636960E+03 -1.5885274E-03 9.7370776E-04 -5.0745903E-04 1.8909446E-04 7 2.7508794E+03 -3.9823891E-03 2.4554034E-03 -1.2822011E-03 4.7795613E-04 8 1.3906289E+03 -8.9114050E-03 5.5316563E-03 -2.8929634E-03 1.0788437E-03 9 7.3554061E+02 -1.7424151E-02 1.0957564E-02 -5.7536797E-03 2.1474431E-03 10 4.0377943E+02 -2.8614274E-02 1.8170276E-02 -9.5608625E-03 3.5702940E-03 11 2.2793463E+02 -3.6875160E-02 2.3198250E-02 -1.2184023E-02 4.5476851E-03 12 1.3161684E+02 -3.4330939E-02 1.9381487E-02 -9.7503169E-03 3.6002947E-03 13 7.7111759E+01 -2.0145150E-02 2.3125841E-03 8.9187360E-04 -5.2495977E-04 14 4.5482552E+01 -6.3606197E-03 -1.6683396E-02 1.2881629E-02 -5.1928678E-03 15 2.7017663E+01 -7.6714244E-04 -2.1979425E-02 1.6338807E-02 -6.5659918E-03 16 1.6116946E+01 9.2936458E-06 -1.1951393E-02 3.9945180E-03 -9.3056332E-04 17 9.5374137E+00 3.0457165E-05 -2.7624185E-03 -1.0050948E-02 5.5142771E-03 18 5.5384663E+00 1.4190583E-05 -2.0201852E-04 -1.1392477E-02 6.0425897E-03 19 3.1655710E+00 7.7325117E-06 -2.9792926E-06 -4.8408586E-03 9.7331991E-04 20 1.7569544E+00 3.4706343E-06 2.8334965E-06 -7.8322747E-04 -3.6334870E-03 21 9.4241219E-01 1.7191276E-06 8.9906201E-07 -3.4423486E-05 -4.0834742E-03 22 4.8606519E-01 8.4611778E-07 6.2926250E-07 -1.2515871E-06 -2.2510301E-03 23 2.3901036E-01 2.9426135E-07 1.6858586E-07 4.9806727E-07 -6.4145739E-04 24 1.0633467E-01 2.2213664E-07 1.4755163E-07 1.1570906E-07 -5.3457307E-05 3d+ 4d+ 5d+ 6d+ 1 1.2458824E+06 -2.6229813E-07 1.6123026E-07 -8.3558364E-08 2.9678842E-08 2 2.8490663E+05 -2.3569099E-06 1.4374467E-06 -7.4384022E-07 2.6497004E-07 3 8.7802543E+04 -1.4331185E-05 8.7799203E-06 -4.5474957E-06 1.6174848E-06 4 3.1870538E+04 -6.8521450E-05 4.1908333E-05 -2.1700069E-05 7.7253168E-06 5 1.2969100E+04 -2.7134114E-04 1.6642328E-04 -8.6230803E-05 3.0684970E-05 6 5.7636960E+03 -9.1857613E-04 5.6430306E-04 -2.9253964E-04 1.0415248E-04 7 2.7508794E+03 -2.6856517E-03 1.6588663E-03 -8.6122128E-04 3.0662777E-04 8 1.3906289E+03 -6.7582928E-03 4.2034354E-03 -2.1865091E-03 7.7899677E-04 9 7.3554061E+02 -1.4448551E-02 9.1091447E-03 -4.7563174E-03 1.6956242E-03 10 4.0377943E+02 -2.5504342E-02 1.6298647E-02 -8.5412830E-03 3.0479753E-03 11 2.2793463E+02 -3.5196542E-02 2.2471610E-02 -1.1778359E-02 4.2024793E-03 12 1.3161684E+02 -3.5326423E-02 2.1050316E-02 -1.0761137E-02 3.8175851E-03 13 7.7111759E+01 -2.2590130E-02 6.0363479E-03 -1.4734475E-03 3.8135447E-04 14 4.5482552E+01 -7.9996397E-03 -1.3610910E-02 1.0770231E-02 -4.1550759E-03 15 2.7017663E+01 -1.2132947E-03 -2.1896486E-02 1.6440863E-02 -6.3248727E-03 16 1.6116946E+01 -6.3589872E-05 -1.3421316E-02 6.3463196E-03 -1.9552203E-03 17 9.5374137E+00 3.4384079E-06 -3.5220556E-03 -8.2632749E-03 4.3641276E-03 18 5.5384663E+00 1.2998747E-06 -3.2095332E-04 -1.1564762E-02 5.8734209E-03 19 3.1655710E+00 8.8733091E-07 -1.2355190E-05 -5.6039202E-03 1.8081937E-03 20 1.7569544E+00 -5.4966694E-08 -3.0736745E-07 -1.0494904E-03 -2.8414452E-03 21 9.4241219E-01 4.7824587E-08 2.6112043E-08 -5.9422321E-05 -3.9423547E-03 22 4.8606519E-01 -1.1740388E-08 3.2540739E-08 -3.3015610E-06 -2.4871987E-03 23 2.3901036E-01 2.0190283E-09 -5.5050691E-09 2.9727905E-07 -8.4834428E-04 24 1.0633467E-01 1.1249126E-10 -1.1498437E-09 -6.9729978E-09 -1.0302022E-04 4f- 5f- 1 6.9737416E+03 -3.2754883E-05 1.6175636E-05 2 2.2290073E+03 -2.1878990E-04 1.0901121E-04 3 9.2124970E+02 -9.5811184E-04 4.7617177E-04 4 4.3389933E+02 -3.1762969E-03 1.5907261E-03 5 2.2194091E+02 -7.9261480E-03 3.9687271E-03 6 1.1925774E+02 -1.5208537E-02 7.6773839E-03 7 6.6405441E+01 -2.1743478E-02 1.0633505E-02 8 3.7580921E+01 -2.2143862E-02 9.8582461E-03 9 2.1544229E+01 -1.4859103E-02 3.3749786E-03 10 1.2321911E+01 -5.6653655E-03 -6.2062822E-03 11 6.9047998E+00 -9.6582139E-04 -1.0614621E-02 12 3.7888954E+00 -4.1091417E-05 -8.1260260E-03 13 2.0031370E+00 -3.6089976E-07 -3.3345244E-03 14 9.9243102E-01 1.0550631E-06 -6.1762251E-04 15 4.2886320E-01 5.5573459E-08 -3.0221721E-05 16 1.6496259E-01 3.8085833E-08 -2.3177490E-07 4f+ 5f+ 1 6.9737416E+03 -2.0205886E-05 9.8895930E-06 2 2.2290073E+03 -1.6297031E-04 8.0657695E-05 3 9.2124970E+02 -7.9301481E-04 3.9125956E-04 4 4.3389933E+02 -2.7883386E-03 1.3867670E-03 5 2.2194091E+02 -7.2904958E-03 3.6261094E-03 6 1.1925774E+02 -1.4452266E-02 7.2510963E-03 7 6.6405441E+01 -2.1133430E-02 1.0324225E-02 8 3.7580921E+01 -2.2151386E-02 9.9255904E-03 9 2.1544229E+01 -1.5333724E-02 3.9210014E-03 10 1.2321911E+01 -6.0554400E-03 -5.5236378E-03 11 6.9047998E+00 -1.0946681E-03 -1.0372998E-02 12 3.7888954E+00 -5.4181102E-05 -8.2693091E-03 13 2.0031370E+00 -2.0236696E-06 -3.5498890E-03 14 9.9243102E-01 8.3083554E-07 -7.1172010E-04 15 4.2886320E-01 -6.5659672E-08 -4.0097966E-05 16 1.6496259E-01 2.3013873E-08 -3.2786658E-07 ** Uup 291 ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2491197E+07 1.8945973E-03 -8.9985710E-04 4.4858238E-04 2.4251255E-04 -1.3234263E-04 6.7375045E-05 -2.7022586E-05 2 1.3955363E+07 4.1567661E-03 -1.9875534E-03 9.9204455E-04 5.3649544E-04 -2.9280328E-04 1.4906939E-04 -5.9788544E-05 3 4.7444073E+06 7.4685365E-03 -3.5980239E-03 1.7984018E-03 9.7292771E-04 -5.3105044E-04 2.7037172E-04 -1.0844158E-04 4 1.7823406E+06 1.2113908E-02 -5.9040308E-03 2.9573022E-03 1.6007818E-03 -8.7390555E-04 4.4495227E-04 -1.7846363E-04 5 7.3341245E+05 1.9162452E-02 -9.4644656E-03 4.7522599E-03 2.5740071E-03 -1.4054547E-03 7.1562611E-04 -2.8703330E-04 6 3.1928682E+05 2.9359358E-02 -1.4764210E-02 7.4371053E-03 4.0316082E-03 -2.2019483E-03 1.1212836E-03 -4.4974098E-04 7 1.4662612E+05 4.4508470E-02 -2.2827820E-02 1.1539509E-02 6.2611097E-03 -3.4203936E-03 1.7418316E-03 -6.9866567E-04 8 7.0043918E+04 6.6195230E-02 -3.4758444E-02 1.7641894E-02 9.5824866E-03 -5.2369636E-03 2.6673133E-03 -1.0698789E-03 9 3.4760996E+04 9.6088081E-02 -5.1670817E-02 2.6340297E-02 1.4322631E-02 -7.8289023E-03 3.9874348E-03 -1.5994846E-03 10 1.7833590E+04 1.3285190E-01 -7.3270252E-02 3.7511956E-02 2.0422205E-02 -1.1170258E-02 5.6910005E-03 -2.2827592E-03 11 9.4934630E+03 1.6779204E-01 -9.4214238E-02 4.8394127E-02 2.6362012E-02 -1.4412452E-02 7.3398588E-03 -2.9444833E-03 12 5.2796348E+03 1.8048938E-01 -1.0042508E-01 5.1146816E-02 2.7805750E-02 -1.5220320E-02 7.7603362E-03 -3.1122665E-03 13 3.1613072E+03 1.4569535E-01 -6.9823042E-02 3.3447945E-02 1.7756723E-02 -9.5606324E-03 4.8313458E-03 -1.9384605E-03 14 2.0871349E+03 1.0295142E-01 -2.4250093E-02 4.1885462E-03 9.6740980E-04 -4.6384414E-04 2.6362480E-04 -9.9625935E-05 15 1.3628922E+03 7.3658361E-02 6.6785738E-02 -6.1252579E-02 -3.8493181E-02 2.2239357E-02 -1.1575668E-02 4.6513879E-03 16 8.5007168E+02 2.7123192E-02 2.1111277E-01 -1.8577104E-01 -1.1622947E-01 6.5792516E-02 -3.3744042E-02 1.3580179E-02 17 5.4996428E+02 4.1765699E-03 2.9495030E-01 -2.8015753E-01 -1.8202099E-01 1.0593934E-01 -5.5164353E-02 2.2196550E-02 18 3.6017841E+02 5.9444542E-04 3.0102621E-01 -3.3104832E-01 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-6.1990331E-03 5 2.3099948E+02 4.4321163E-02 -2.2388361E-02 6 1.2410346E+02 1.1944038E-01 -6.0859290E-02 7 6.9117564E+01 2.3484702E-01 -1.1664731E-01 8 3.9140259E+01 3.2949848E-01 -1.5040449E-01 9 2.2462698E+01 3.0436697E-01 -8.1581194E-02 10 1.2874500E+01 1.6125374E-01 1.3984453E-01 11 7.2447405E+00 3.9884714E-02 3.5921092E-01 12 4.0088311E+00 2.8264330E-03 3.8711567E-01 13 2.1533604E+00 1.4281652E-04 2.2915582E-01 14 1.0944519E+00 -7.8820244E-05 6.7219951E-02 15 4.8241565E-01 7.3916740E-06 6.0569958E-03 16 1.7263001E-01 -4.1378167E-06 1.0979142E-05 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2491197E+07 -1.7431154E-03 8.2465646E-04 -4.1079183E-04 -2.2203890E-04 1.2116220E-04 -6.1681838E-05 2.4739061E-05 2 1.3955363E+07 -5.5600617E-03 2.6310324E-03 -1.3106618E-03 -7.0844211E-04 3.8658928E-04 -1.9680886E-04 7.8935143E-05 3 4.7444073E+06 -9.7750404E-03 4.6323200E-03 -2.3083074E-03 -1.2477820E-03 6.8090411E-04 -3.4663926E-04 1.3902872E-04 4 1.7823406E+06 -1.6204751E-02 7.6897585E-03 -3.8328273E-03 -2.0720437E-03 1.1307543E-03 -5.7566788E-04 2.3088665E-04 5 7.3341245E+05 -2.4126505E-02 1.1471247E-02 -5.7202429E-03 -3.0927144E-03 1.6877400E-03 -8.5921143E-04 3.4461068E-04 6 3.1928682E+05 -3.5197304E-02 1.6774033E-02 -8.3686800E-03 -4.5253488E-03 2.4698173E-03 -1.2574344E-03 5.0432909E-04 7 1.4662612E+05 -4.8372290E-02 2.3133291E-02 -1.1552368E-02 -6.2483267E-03 3.4101066E-03 -1.7360730E-03 6.9630686E-04 8 7.0043918E+04 -6.4620486E-02 3.1060776E-02 -1.5530840E-02 -8.4035910E-03 4.5875496E-03 -2.3358276E-03 9.3685835E-04 9 3.4760996E+04 -8.0941527E-02 3.9207420E-02 -1.9651685E-02 -1.0639563E-02 5.8080021E-03 -2.9569260E-03 1.1859970E-03 10 1.7833590E+04 -9.5085396E-02 4.6563351E-02 -2.3409762E-02 -1.2686981E-02 6.9302798E-03 -3.5295808E-03 1.4156852E-03 11 9.4934630E+03 -9.8850197E-02 4.8920624E-02 -2.4701707E-02 -1.3399075E-02 7.3158949E-03 -3.7241886E-03 1.4938255E-03 12 5.2796348E+03 -8.7473329E-02 4.2891917E-02 -2.1573709E-02 -1.1697807E-02 6.3987679E-03 -3.2621024E-03 1.3083284E-03 13 3.1613072E+03 -5.7140462E-02 2.4740123E-02 -1.1954384E-02 -6.3741617E-03 3.4384779E-03 -1.7386081E-03 6.9735836E-04 14 2.0871349E+03 -3.5086389E-02 8.6844960E-03 -2.4931891E-03 -1.0631857E-03 5.7648851E-04 -3.0379193E-04 1.2070152E-04 15 1.3628922E+03 -1.9786799E-02 -1.3845327E-02 1.2421535E-02 7.7781080E-03 -4.4967647E-03 2.3431073E-03 -9.4172186E-04 16 8.5007168E+02 -6.6040338E-03 -3.7615135E-02 3.2234627E-02 2.0040707E-02 -1.1318368E-02 5.7996527E-03 -2.3334616E-03 17 5.4996428E+02 -2.9466039E-04 -4.4144834E-02 4.0734672E-02 2.6326073E-02 -1.5302459E-02 7.9661642E-03 -3.2054118E-03 18 3.6017841E+02 -4.2612250E-04 -3.6734223E-02 3.9566523E-02 2.6434244E-02 -1.5241152E-02 7.8520149E-03 -3.1639001E-03 19 2.2738767E+02 2.2015139E-04 -1.8384356E-02 1.0883017E-02 6.0461667E-03 -3.5528913E-03 1.8904115E-03 -7.5930467E-04 20 1.3445737E+02 -1.4660622E-04 -3.1807676E-03 -3.1675951E-02 -3.6570610E-02 2.5496419E-02 -1.4007337E-02 5.7063421E-03 21 8.2390838E+01 1.2827381E-04 2.2302360E-05 -3.4599919E-02 -4.7564286E-02 3.4346823E-02 -1.8896845E-02 7.7213548E-03 22 5.0525006E+01 -1.2629165E-04 -6.3089822E-05 -1.2218426E-02 -1.2870187E-02 9.3915110E-03 -5.6200859E-03 2.3262831E-03 23 3.3042925E+01 1.2732452E-04 3.3621919E-05 -1.2886585E-03 1.9168590E-02 -2.2681134E-02 1.4812462E-02 -6.2605363E-03 24 2.2129136E+01 -1.0454898E-04 -7.8671406E-06 -2.8116107E-04 2.1094039E-02 -3.2700973E-02 2.3254407E-02 -1.0082638E-02 25 1.4478426E+01 6.9683841E-05 -1.4123530E-06 6.4008200E-05 8.5795496E-03 -1.1560607E-02 7.4362355E-03 -3.0963465E-03 26 9.3507147E+00 -4.0277495E-05 3.9690708E-06 -2.5395985E-05 1.0006636E-03 1.3529117E-02 -1.4832374E-02 6.8659463E-03 27 5.6894382E+00 2.1247993E-05 -3.8023814E-06 1.2563692E-05 9.2669267E-05 1.3767121E-02 -1.8325325E-02 9.4617172E-03 28 3.2643861E+00 -1.4227967E-05 3.3372477E-06 -5.6684141E-06 -2.0738306E-05 2.8594836E-03 -1.9354592E-03 9.0966077E-04 29 2.0835764E+00 1.0626234E-05 -2.8886675E-06 3.4598279E-06 1.2690128E-05 -4.5061503E-05 7.4373466E-03 -5.5889027E-03 30 1.2547722E+00 -6.5785191E-06 2.0185441E-06 -1.8164623E-06 -6.5981882E-06 6.6236898E-05 4.5173716E-03 -4.4586259E-03 31 7.8143289E-01 3.7841316E-06 -1.2543048E-06 8.5714045E-07 2.8193157E-06 -2.2581593E-05 1.1685849E-03 -9.7139478E-04 32 4.5486372E-01 -1.7306980E-06 6.1322958E-07 -3.2767262E-07 -9.7943952E-07 6.5101961E-06 1.4122220E-04 1.2769419E-03 33 2.6422197E-01 6.9065572E-07 -2.5687623E-07 1.1013863E-07 2.8677033E-07 -1.8468107E-06 1.3231825E-06 2.0301024E-03 34 1.3717656E-01 -1.8887031E-07 7.3210473E-08 -2.4808766E-08 -5.0302300E-08 3.1151828E-07 9.5352936E-07 1.0190230E-03 35 6.1400603E-02 3.4106025E-08 -1.3677267E-08 3.7501122E-09 5.2821326E-09 -3.1566571E-08 -2.0056577E-07 1.0862056E-04 2p- 3p- 4p- 5p- 6p- 7p- 1 8.8595892E+07 -3.7016588E-05 1.9547744E-05 -1.0609902E-05 5.7072457E-06 2.7914598E-06 9.5806485E-07 2 3.8521084E+07 -1.6451865E-04 8.6913265E-05 -4.7178929E-05 2.5375437E-05 1.2408848E-05 4.2586786E-06 3 1.6451656E+07 -3.7459002E-04 1.9799447E-04 -1.0749068E-04 5.7823181E-05 2.8281013E-05 9.7063388E-06 4 7.1926190E+06 -6.8617307E-04 3.6298282E-04 -1.9710517E-04 1.0602491E-04 5.1848824E-05 1.7794462E-05 5 3.2161149E+06 -1.1472359E-03 6.0751500E-04 -3.2997620E-04 1.7753274E-04 8.6834821E-05 2.9802927E-05 6 1.4669872E+06 -1.8274111E-03 9.6916947E-04 -5.2662068E-04 2.8332542E-04 1.3855793E-04 4.7553211E-05 7 6.8071175E+05 -2.8352485E-03 1.5066128E-03 -8.1905647E-04 4.4078860E-04 2.1561963E-04 7.4005133E-05 8 3.2096276E+05 -4.3290270E-03 2.3066715E-03 -1.2548887E-03 6.7536156E-04 3.3030270E-04 1.1336156E-04 9 1.5366839E+05 -6.5546909E-03 3.5047119E-03 -1.9083214E-03 1.0274930E-03 5.0269822E-04 1.7254205E-04 10 7.4655896E+04 -9.8809606E-03 5.3078687E-03 -2.8936040E-03 1.5581944E-03 7.6217539E-04 2.6158871E-04 11 3.6795374E+04 -1.4830375E-02 8.0131965E-03 -4.3748508E-03 2.3574430E-03 1.1536716E-03 3.9599709E-04 12 1.8406518E+04 -2.2054520E-02 1.2009147E-02 -6.5695053E-03 3.5411032E-03 1.7324994E-03 5.9464221E-04 13 9.3577219E+03 -3.2069394E-02 1.7636629E-02 -9.6723525E-03 5.2191833E-03 2.5552429E-03 8.7716076E-04 14 4.8469532E+03 -4.4455349E-02 2.4769659E-02 -1.3630207E-02 7.3591386E-03 3.6018654E-03 1.2363465E-03 15 2.5640376E+03 -5.6390819E-02 3.1845443E-02 -1.7581602E-02 9.5065924E-03 4.6576595E-03 1.5991073E-03 16 1.3868465E+03 -6.1415603E-02 3.4699695E-02 -1.9137718E-02 1.0335330E-02 5.0572170E-03 1.7357826E-03 17 7.6774319E+02 -5.1888001E-02 2.6489499E-02 -1.3984603E-02 7.4532881E-03 3.6400642E-03 1.2490261E-03 18 4.3488315E+02 -2.8905832E-02 2.6672151E-03 1.8768807E-03 -1.6470184E-03 -9.0618355E-04 -3.1785577E-04 19 2.5133617E+02 -7.8259733E-03 -2.7038339E-02 2.3604363E-02 -1.4398952E-02 -7.2749390E-03 -2.5121204E-03 20 1.4826094E+02 3.9931437E-04 -3.9884188E-02 3.5238528E-02 -2.1969111E-02 -1.1224979E-02 -3.8852026E-03 21 8.8947607E+01 1.1407738E-03 -2.6003483E-02 1.8912795E-02 -1.0336388E-02 -4.9893833E-03 -1.7062876E-03 22 5.3289873E+01 8.4376480E-04 -7.5085746E-03 -1.2892807E-02 1.3669583E-02 7.7941930E-03 2.7518832E-03 23 3.1997441E+01 5.5552671E-04 -6.2226336E-04 -2.6108990E-02 2.7142981E-02 1.6267340E-02 5.8087430E-03 24 1.9489552E+01 3.8164401E-04 -2.7263305E-05 -1.3265389E-02 1.0658359E-02 5.2207337E-03 1.7695389E-03 25 1.1674663E+01 2.7439257E-04 3.6806937E-05 -2.2729278E-03 -1.3110211E-02 -1.2132114E-02 -4.6471214E-03 26 6.8825431E+00 1.8271976E-04 6.5713663E-06 -1.9856370E-05 -1.3714395E-02 -1.2731619E-02 -4.9941609E-03 27 4.0384544E+00 1.3001154E-04 1.3321072E-05 2.7583255E-06 -3.8323043E-03 -1.4673197E-04 2.6192522E-04 28 2.3349338E+00 8.2137169E-05 3.9147419E-06 2.4689679E-05 -3.2445395E-04 7.2266869E-03 3.9611276E-03 29 1.3354373E+00 6.2606602E-05 5.2741648E-06 7.5528567E-06 -1.0655521E-06 4.6671636E-03 2.6847940E-03 30 7.6046347E-01 3.1777759E-05 1.8566647E-06 7.8049910E-06 -2.4518078E-06 1.1494588E-03 6.6230929E-05 31 4.3020400E-01 3.2106943E-05 2.4172161E-06 5.1810779E-06 1.8003079E-06 1.2411827E-04 -1.5686156E-03 32 2.2986305E-01 1.1796223E-05 7.8803011E-07 2.4426939E-06 -4.2592552E-07 1.0067523E-05 -1.8113686E-03 33 1.1658824E-01 1.7790181E-05 1.2694572E-06 3.2253935E-06 1.2642648E-07 3.1862382E-07 -9.5567497E-04 34 5.6626962E-02 7.5816483E-07 5.1497937E-08 1.5913060E-07 -4.0821647E-08 7.2776847E-08 -1.7037518E-04 35 2.6358431E-02 9.7619085E-06 6.9008107E-07 1.8093836E-06 -2.0121744E-08 -3.3053918E-07 -2.3958334E-06 2p+ 3p+ 4p+ 5p+ 6p+ 7p+ 1 8.8595892E+07 -1.5633129E-07 9.0038454E-08 -5.1197519E-08 2.8306158E-08 -1.3131928E-08 3.6664041E-09 2 3.8521084E+07 -9.5322806E-07 5.4610033E-07 -3.0238125E-07 1.5972394E-07 -7.1461290E-08 1.9772860E-08 3 1.6451656E+07 -2.7636118E-06 1.5880238E-06 -8.9283227E-07 4.8434168E-07 -2.2141165E-07 6.1594713E-08 4 7.1926190E+06 -7.1557755E-06 4.1032366E-06 -2.2812887E-06 1.2137036E-06 -5.4622929E-07 1.5136387E-07 5 3.2161149E+06 -1.7731716E-05 1.0185306E-05 -5.7105344E-06 3.0828262E-06 -1.4038551E-06 3.9016610E-07 6 1.4669872E+06 -4.2937232E-05 2.4638360E-05 -1.3728933E-05 7.3320490E-06 -3.3100216E-06 9.1794369E-07 7 6.8071175E+05 -1.0182822E-04 5.8500030E-05 -3.2750667E-05 1.7632385E-05 -8.0118548E-06 2.2254770E-06 8 3.2096276E+05 -2.3671774E-04 1.3596576E-04 -7.5867499E-05 4.0603811E-05 -1.8361378E-05 5.0941755E-06 9 1.5366839E+05 -5.3882220E-04 3.0988077E-04 -1.7339511E-04 9.3224623E-05 -4.2310775E-05 1.1749377E-05 10 7.4655896E+04 -1.1995312E-03 6.9050343E-04 -3.8575565E-04 2.0671217E-04 -9.3562681E-05 2.5963864E-05 11 3.6795374E+04 -2.5990691E-03 1.5000193E-03 -8.3982285E-04 4.5131627E-04 -2.0472495E-04 5.6842603E-05 12 1.8406518E+04 -5.4402050E-03 3.1517993E-03 -1.7644727E-03 9.4652349E-04 -4.2866417E-04 1.1897092E-04 13 9.3577219E+03 -1.0853077E-02 6.3346449E-03 -3.5572410E-03 1.9127981E-03 -8.6765918E-04 2.4090188E-04 14 4.8469532E+03 -2.0216229E-02 1.1946010E-02 -6.7260124E-03 3.6147808E-03 -1.6380638E-03 4.5467722E-04 15 2.5640376E+03 -3.4095297E-02 2.0557403E-02 -1.1651626E-02 6.2824916E-03 -2.8518269E-03 7.9188745E-04 16 1.3868465E+03 -4.9702069E-02 3.0826080E-02 -1.7600833E-02 9.4977512E-03 -4.3083311E-03 1.1960463E-03 17 7.6774319E+02 -5.8360404E-02 3.7304189E-02 -2.1525928E-02 1.1675409E-02 -5.3099046E-03 1.4749495E-03 18 4.3488315E+02 -4.9596219E-02 2.9836224E-02 -1.6699264E-02 8.9290242E-03 -4.0350226E-03 1.1193002E-03 19 2.5133617E+02 -2.6455101E-02 3.8202090E-03 9.5743280E-04 -1.0453708E-03 5.2986944E-04 -1.4923756E-04 20 1.4826094E+02 -7.1503870E-03 -2.6656278E-02 2.5150175E-02 -1.5705014E-02 7.4294240E-03 -2.0773584E-03 21 8.8947607E+01 -7.3661986E-04 -3.4643443E-02 3.2987378E-02 -2.0397102E-02 9.5606905E-03 -2.6672717E-03 22 5.3289873E+01 -1.5325932E-05 -1.8470327E-02 1.0884524E-02 -5.4803900E-03 2.4849198E-03 -6.9146468E-04 23 3.1997441E+01 3.9170255E-06 -3.8001408E-03 -1.7916180E-02 1.8234609E-02 -9.8615818E-03 2.8192823E-03 24 1.9489552E+01 1.9819140E-06 -2.3743942E-04 -2.1144095E-02 2.3178268E-02 -1.2554424E-02 3.5817531E-03 25 1.1674663E+01 -6.0259746E-07 1.9744266E-06 -7.3563491E-03 6.2136691E-04 1.0656007E-03 -3.6781261E-04 26 6.8825431E+00 -5.5656061E-08 2.2297915E-06 -7.3657190E-04 -1.3823307E-02 1.1279347E-02 -3.4445064E-03 27 4.0384544E+00 -8.6592557E-08 1.8745800E-06 -3.7136623E-05 -8.3530886E-03 7.2287863E-03 -2.2448905E-03 28 2.3349338E+00 -8.9894485E-10 -6.3951069E-07 6.2495709E-06 -1.5383265E-03 -2.5913516E-03 1.0890691E-03 29 1.3354373E+00 2.5857478E-08 2.1291028E-07 -2.2361425E-06 -8.3002285E-05 -5.4132505E-03 2.2497474E-03 30 7.6046347E-01 -1.9873080E-08 -1.1916386E-07 1.4603272E-06 -2.7781147E-06 -2.8272666E-03 1.2795306E-03 31 4.3020400E-01 1.5735666E-08 2.5480456E-08 -5.1978185E-07 1.9243759E-07 -6.7288454E-04 -4.3702282E-05 32 2.2986305E-01 -8.7204186E-09 -2.1821286E-09 1.7236580E-07 2.8167251E-07 -6.6398553E-05 -9.6939409E-04 33 1.1658824E-01 4.3774413E-09 -3.0562324E-09 -5.1625035E-08 2.2379371E-10 -4.1722002E-06 -1.1795355E-03 34 5.6626962E-02 -1.9169770E-09 2.6624573E-09 9.9435711E-09 3.3365031E-08 -1.2918790E-06 -7.3455486E-04 35 2.6358431E-02 5.5442408E-10 -9.4585140E-10 -1.4653307E-09 9.2280698E-10 -2.0169900E-07 -1.5073479E-04 3d- 4d- 5d- 6d- 1 1.2616748E+06 -3.5474147E-06 2.1628244E-06 -1.1323241E-06 4.3550969E-07 2 2.8662303E+05 -1.6609332E-05 1.0121275E-05 -5.2924049E-06 2.0345539E-06 3 8.7855770E+04 -6.1676371E-05 3.7690022E-05 -1.9743359E-05 7.5944957E-06 4 3.1791722E+04 -2.0341943E-04 1.2436799E-04 -6.5098611E-05 2.5032252E-05 5 1.2905853E+04 -6.1146145E-04 3.7511983E-04 -1.9668748E-04 7.5672688E-05 6 5.7257848E+03 -1.6831695E-03 1.0350320E-03 -5.4268778E-04 2.0876352E-04 7 2.7318216E+03 -4.1981925E-03 2.5970725E-03 -1.3647833E-03 5.2534485E-04 8 1.3816948E+03 -9.3304410E-03 5.8117110E-03 -3.0581434E-03 1.1773958E-03 9 7.3169894E+02 -1.8085006E-02 1.1414279E-02 -6.0322649E-03 2.3250316E-03 10 4.0235578E+02 -2.9373757E-02 1.8705512E-02 -9.9012868E-03 3.8170793E-03 11 2.2748096E+02 -3.7387370E-02 2.3552549E-02 -1.2443756E-02 4.7962838E-03 12 1.3150853E+02 -3.4257260E-02 1.9134756E-02 -9.6157774E-03 3.6567127E-03 13 7.7038004E+01 -1.9680717E-02 1.3490195E-03 1.5496700E-03 -8.1193572E-04 14 4.5388023E+01 -5.9896287E-03 -1.7613487E-02 1.3658844E-02 -5.6991720E-03 15 2.6994011E+01 -6.6791850E-04 -2.2016553E-02 1.6409714E-02 -6.8013464E-03 16 1.6114236E+01 1.2490502E-05 -1.1480218E-02 3.1205573E-03 -5.1498895E-04 17 9.5457064E+00 3.1999386E-05 -2.5248250E-03 -1.0627287E-02 6.0399603E-03 18 5.5737719E+00 1.3491492E-05 -1.7286731E-04 -1.1273202E-02 6.1895377E-03 19 3.2100412E+00 8.0139167E-06 -2.6112404E-06 -4.6178584E-03 7.1768164E-04 20 1.7999468E+00 3.4160679E-06 3.0764524E-06 -7.2766889E-04 -3.9269898E-03 21 9.7727630E-01 1.8006457E-06 8.7794968E-07 -3.0992315E-05 -4.2137135E-03 22 5.1139672E-01 8.7939036E-07 6.6473345E-07 -6.5812407E-07 -2.2146518E-03 23 2.5468564E-01 3.1786594E-07 1.7789700E-07 5.4675980E-07 -5.7546244E-04 24 1.1303759E-01 2.4158833E-07 1.6134243E-07 1.4483783E-07 -4.0369325E-05 3d+ 4d+ 5d+ 6d+ 1 1.2616748E+06 -2.7128683E-07 1.6742697E-07 -8.7563848E-08 3.2389269E-08 2 2.8662303E+05 -2.4633768E-06 1.5067296E-06 -7.8366910E-07 2.8966784E-07 3 8.7855770E+04 -1.5075067E-05 9.2677875E-06 -4.8348338E-06 1.7878153E-06 4 3.1791722E+04 -7.2253422E-05 4.4331034E-05 -2.3093088E-05 8.5378553E-06 5 1.2905853E+04 -2.8683445E-04 1.7652500E-04 -9.2085234E-05 3.4052757E-05 6 5.7257848E+03 -9.7058855E-04 5.9824218E-04 -3.1208965E-04 1.1541804E-04 7 2.7318216E+03 -2.8269975E-03 1.7523466E-03 -9.1586227E-04 3.3883326E-04 8 1.3816948E+03 -7.0711322E-03 4.4138438E-03 -2.3108034E-03 8.5526334E-04 9 7.3169894E+02 -1.4995293E-02 9.4909901E-03 -4.9896076E-03 1.8484157E-03 10 4.0235578E+02 -2.6201127E-02 1.6800068E-02 -8.8606253E-03 3.2848497E-03 11 2.2748096E+02 -3.5765119E-02 2.2891397E-02 -1.2077438E-02 4.4778824E-03 12 1.3150853E+02 -3.5390801E-02 2.0979218E-02 -1.0749006E-02 3.9561634E-03 13 7.7038004E+01 -2.2209319E-02 5.2505230E-03 -9.5071465E-04 1.8940012E-04 14 4.5388023E+01 -7.6174928E-03 -1.4553684E-02 1.1532894E-02 -4.6322093E-03 15 2.6994011E+01 -1.0895642E-03 -2.2086072E-02 1.6683681E-02 -6.6705837E-03 16 1.6114236E+01 -5.9319742E-05 -1.2993996E-02 5.6226871E-03 -1.6813861E-03 17 9.5457064E+00 5.9871691E-06 -3.2597047E-03 -8.8887919E-03 4.8795116E-03 18 5.5737719E+00 2.4377915E-07 -2.8145750E-04 -1.1533860E-02 6.1286237E-03 19 3.2100412E+00 1.3025672E-06 -1.2387125E-05 -5.3877393E-03 1.6487422E-03 20 1.7999468E+00 -2.4825430E-07 2.4196403E-07 -9.8612956E-04 -3.1436012E-03 21 9.7727630E-01 1.1694891E-07 -1.1343843E-07 -5.5259587E-05 -4.1306447E-03 22 5.1139672E-01 -3.5145094E-08 7.4319401E-08 -2.7804555E-06 -2.4793715E-03 23 2.5468564E-01 8.5123212E-09 -2.0041000E-08 3.4144815E-07 -7.6865550E-04 24 1.1303759E-01 -9.8821116E-10 3.6181180E-10 2.4004692E-08 -8.0014307E-05 4f- 5f- 1 7.2916097E+03 -3.2039546E-05 1.6045535E-05 2 2.3263015E+03 -2.1412017E-04 1.0821460E-04 3 9.6023538E+02 -9.3995915E-04 4.7376779E-04 4 4.5183580E+02 -3.1283710E-03 1.5891200E-03 5 2.3099948E+02 -7.8551044E-03 3.9891243E-03 6 1.2410346E+02 -1.5175317E-02 7.7712009E-03 7 6.9117564E+01 -2.1897651E-02 1.0876944E-02 8 3.9140259E+01 -2.2522604E-02 1.0208310E-02 9 2.2462698E+01 -1.5300358E-02 3.6708167E-03 10 1.2874500E+01 -5.9273192E-03 -6.1942766E-03 11 7.2447405E+00 -1.0376238E-03 -1.0832852E-02 12 4.0088311E+00 -4.7196585E-05 -8.3364942E-03 13 2.1533604E+00 -5.0209568E-07 -3.4584003E-03 14 1.0944519E+00 1.1775796E-06 -6.6933212E-04 15 4.8241565E-01 8.1817245E-08 -3.5266662E-05 16 1.7263001E-01 4.0486571E-08 -1.3618122E-08 4f+ 5f+ 1 7.2916097E+03 -1.9518473E-05 9.6917683E-06 2 2.3263015E+03 -1.5817586E-04 7.9441441E-05 3 9.6023538E+02 -7.7379452E-04 3.8735899E-04 4 4.5183580E+02 -2.7359210E-03 1.3807178E-03 5 2.3099948E+02 -7.2059405E-03 3.6367419E-03 6 1.2410346E+02 -1.4396953E-02 7.3305114E-03 7 6.9117564E+01 -2.1259259E-02 1.0553386E-02 8 3.9140259E+01 -2.2514325E-02 1.0274103E-02 9 2.2462698E+01 -1.5785767E-02 4.2362622E-03 10 1.2874500E+01 -6.3362803E-03 -5.4825655E-03 11 7.2447405E+00 -1.1763754E-03 -1.0578205E-02 12 4.0088311E+00 -6.1874701E-05 -8.4834845E-03 13 2.1533604E+00 -2.3588848E-06 -3.6809845E-03 14 1.0944519E+00 9.2851832E-07 -7.6983860E-04 15 4.8241565E-01 -6.4399947E-08 -4.6049351E-05 16 1.7263001E-01 2.0917211E-08 -5.0985500E-08 ** Uuh 293 ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2379926E+07 2.0144367E-03 -9.6286260E-04 4.8022262E-04 2.5992064E-04 -1.4229217E-04 7.3085300E-05 -3.0120465E-05 2 1.3924329E+07 4.4091557E-03 -2.1218500E-03 1.0596151E-03 5.7370922E-04 -3.1410613E-04 1.6133867E-04 -6.6492540E-05 3 4.7322187E+06 7.8958409E-03 -3.8288757E-03 1.9148085E-03 1.0371263E-03 -5.6789036E-04 2.9170311E-04 -1.2022065E-04 4 1.7765482E+06 1.2760232E-02 -6.2608600E-03 3.1378464E-03 1.7005307E-03 -9.3130713E-04 4.7840040E-04 -1.9716697E-04 5 7.3036170E+05 2.0108530E-02 -1.0000204E-02 5.0243051E-03 2.7246314E-03 -1.4924436E-03 7.6669279E-04 -3.1598787E-04 6 3.1755048E+05 3.0686289E-02 -1.5540966E-02 7.8336255E-03 4.2517005E-03 -2.3295257E-03 1.1968062E-03 -4.9326364E-04 7 1.4562739E+05 4.6298625E-02 -2.3918424E-02 1.2098936E-02 6.5727088E-03 -3.6021519E-03 1.8507749E-03 -7.6281477E-04 8 6.9505217E+04 6.8385986E-02 -3.6170044E-02 1.8371738E-02 9.9910112E-03 -5.4774411E-03 2.8145611E-03 -1.1600635E-03 9 3.4513516E+04 9.8320497E-02 -5.3237184E-02 2.7153338E-02 1.4782705E-02 -8.1066779E-03 4.1659824E-03 -1.7171370E-03 10 1.7739932E+04 1.3461913E-01 -7.4659535E-02 3.8239196E-02 2.0840409E-02 -1.1433419E-02 5.8761526E-03 -2.4220157E-03 11 9.4501659E+03 1.6931004E-01 -9.5302726E-02 4.8907021E-02 2.6666487E-02 -1.4628650E-02 7.5185765E-03 -3.0992139E-03 12 5.2204463E+03 1.8462696E-01 -1.0185403E-01 5.1697261E-02 2.8087594E-02 -1.5399360E-02 7.9120992E-03 -3.2605879E-03 13 3.0177305E+03 1.6041387E-01 -7.1575349E-02 3.2675068E-02 1.7123616E-02 -9.2528367E-03 4.7366565E-03 -1.9520907E-03 14 1.8496131E+03 1.0205909E-01 5.9028035E-04 -1.4264976E-02 -1.0255645E-02 5.9877837E-03 -3.1437136E-03 1.3071278E-03 15 1.2410420E+03 4.6131419E-02 8.1951553E-02 -7.1276215E-02 -4.4281750E-02 2.5452687E-02 -1.3236452E-02 5.4576820E-03 16 8.5987447E+02 2.2184662E-02 1.7909446E-01 -1.5757057E-01 -9.9148499E-02 5.6483837E-02 -2.9401754E-02 1.2176395E-02 17 5.7548802E+02 4.3745438E-03 2.9530730E-01 -2.8183920E-01 -1.8257504E-01 1.0606607E-01 -5.5389270E-02 2.2883742E-02 18 3.7079951E+02 9.0076024E-04 3.0872765E-01 -3.3278427E-01 -2.2362510E-01 1.3021521E-01 -6.8204309E-02 2.8275780E-02 19 2.3442462E+02 -3.2147364E-04 1.7787678E-01 -1.1265774E-01 -6.1441746E-02 3.5212311E-02 -1.8274305E-02 7.4884126E-03 20 1.4620622E+02 2.5538427E-04 4.3535108E-02 3.4962062E-01 3.9731001E-01 -2.7573174E-01 1.5189687E-01 -6.3503554E-02 21 9.4492348E+01 -2.8141662E-04 2.6788016E-03 5.3580675E-01 7.2539821E-01 -5.2588490E-01 2.9374947E-01 -1.2360420E-01 22 6.2359752E+01 2.5030901E-04 6.7769295E-04 3.4703387E-01 4.5995953E-01 -3.3590477E-01 1.8876009E-01 -7.9074528E-02 23 4.0663476E+01 -2.4708858E-04 -3.8593464E-04 1.0953918E-01 -1.2321225E-01 1.4798213E-01 -8.1746712E-02 3.3187916E-02 24 2.9045340E+01 2.0373337E-04 1.2996021E-04 6.6358422E-03 -6.6184486E-01 8.9130708E-01 -6.2746422E-01 2.7969198E-01 25 1.9196278E+01 -1.0816822E-04 -1.0992016E-04 4.8924889E-03 -6.2765318E-01 1.0317180E+00 -7.3776024E-01 3.2555700E-01 26 1.2128714E+01 5.9773509E-05 4.6182509E-05 -1.5899768E-03 -1.8248079E-01 -1.3470381E-01 2.2149578E-01 -1.0656168E-01 27 7.5552708E+00 -3.7261499E-05 -1.1875662E-05 6.8741185E-04 -1.1761548E-02 -9.5237666E-01 1.1403243E+00 -5.7449502E-01 28 4.7621210E+00 2.3742862E-05 1.5054517E-05 -5.4311207E-04 -1.7321513E-03 -5.4200425E-01 8.1977249E-01 -4.6085612E-01 29 3.0890304E+00 -1.3337231E-05 -7.1010039E-06 2.7921526E-04 4.4975855E-04 -1.1534105E-01 -2.6010370E-01 1.9673487E-01 30 1.8607094E+00 5.7039495E-06 2.0254770E-06 -1.0814458E-04 -1.0689726E-04 -9.2889203E-03 -8.9789128E-01 7.6966723E-01 31 1.0735002E+00 -2.2188556E-06 -1.3491189E-06 4.8409561E-05 8.2939685E-05 3.8620217E-04 -5.2661284E-01 5.7378538E-01 32 5.6343614E-01 8.5724588E-07 3.7959922E-07 -1.7196224E-05 -2.0454631E-05 -3.4487562E-05 -7.3010907E-02 -2.4888972E-01 33 2.9974166E-01 -3.4897862E-07 -1.4488541E-07 6.9079970E-06 6.9610090E-06 4.7556262E-05 -3.2151173E-04 -7.2336044E-01 34 1.4931976E-01 1.0646202E-07 5.8198720E-08 -2.2592437E-06 -3.1263003E-06 -4.7309312E-06 -4.8408640E-04 -4.3264056E-01 35 6.5359317E-02 -1.9843240E-08 -7.1082754E-09 3.8674627E-07 4.1049815E-07 2.2979398E-07 1.7053686E-04 -5.8943266E-02 2p- 3p- 4p- 5p- 6p- 7p- 1 8.9528327E+07 8.5854641E-05 -4.5334908E-05 2.4634540E-05 -1.3298269E-05 -6.5792040E-06 -2.3900962E-06 2 3.9254436E+07 3.9056690E-04 -2.0616987E-04 1.1202122E-04 -6.0469311E-05 -2.9916030E-05 -1.0867866E-05 3 1.6889040E+07 8.3753965E-04 -4.4217285E-04 2.4026055E-04 -1.2969580E-04 -6.4165455E-05 -2.3310026E-05 4 7.4319801E+06 1.4808059E-03 -7.8191864E-04 4.2488497E-04 -2.2935906E-04 -1.1347161E-04 -4.1221903E-05 5 3.3430260E+06 2.4107225E-03 -1.2732728E-03 6.9192788E-04 -3.7352504E-04 -1.8479933E-04 -6.7134058E-05 6 1.5331357E+06 3.7713963E-03 -1.9926332E-03 1.0829425E-03 -5.8461288E-04 -2.8923002E-04 -1.0507151E-04 7 7.1481868E+05 5.7678283E-03 -3.0490191E-03 1.6572873E-03 -8.9472242E-04 -4.4267030E-04 -1.6081445E-04 8 3.3842964E+05 8.7177813E-03 -4.6122986E-03 2.5075488E-03 -1.3537978E-03 -6.6978703E-04 -2.4332126E-04 9 1.6259215E+05 1.3122685E-02 -6.9523637E-03 3.7811552E-03 -2.0417211E-03 -1.0102233E-03 -3.6700130E-04 10 7.9242618E+04 1.9820015E-02 -1.0525755E-02 5.7281760E-03 -3.0934186E-03 -1.5305450E-03 -5.5602538E-04 11 3.9170466E+04 3.0244812E-02 -1.6125268E-02 8.7846442E-03 -4.7459670E-03 -2.3486800E-03 -8.5327538E-04 12 1.9647657E+04 4.6807723E-02 -2.5115963E-02 1.3705349E-02 -7.4069397E-03 -3.6653770E-03 -1.3316261E-03 13 1.0020777E+04 7.3239235E-02 -3.9667355E-02 2.1699349E-02 -1.1738402E-02 -5.8116139E-03 -2.1115369E-03 14 5.2109283E+03 1.1418461E-01 -6.2623515E-02 3.4367851E-02 -1.8602986E-02 -9.2089616E-03 -3.3458420E-03 15 2.7675752E+03 1.7126577E-01 -9.5049142E-02 5.2317975E-02 -2.8357983E-02 -1.4050076E-02 -5.1055312E-03 16 1.5014692E+03 2.3199222E-01 -1.2840571E-01 7.0530239E-02 -3.8168132E-02 -1.8886515E-02 -6.8614435E-03 17 8.3196656E+02 2.5643630E-01 -1.2864549E-01 6.7775115E-02 -3.6226286E-02 -1.7891491E-02 -6.4970206E-03 18 4.7044328E+02 1.9878551E-01 -2.9901053E-02 -3.1386284E-03 5.4414318E-03 3.2938668E-03 1.2401191E-03 19 2.7074129E+02 8.7848396E-02 1.9378150E-01 -1.7275403E-01 1.0607317E-01 5.4269568E-02 1.9848394E-02 20 1.5872313E+02 1.6224300E-02 3.9768783E-01 -3.5247265E-01 2.2061237E-01 1.1408104E-01 4.1806829E-02 21 9.4890277E+01 1.1329188E-03 3.4907016E-01 -2.6368023E-01 1.4812664E-01 7.3022803E-02 2.6498751E-02 22 5.6801830E+01 -1.3015219E-04 1.3787575E-01 1.8906115E-01 -2.0841940E-01 -1.2087402E-01 -4.5291298E-02 23 3.4091498E+01 4.5911133E-05 1.6867967E-02 5.5937804E-01 -5.8077463E-01 -3.5176031E-01 -1.3310522E-01 24 2.0835533E+01 -9.7221648E-05 1.7709070E-03 3.8962059E-01 -3.3778518E-01 -1.7771685E-01 -6.4878819E-02 25 1.2557672E+01 6.2288973E-05 -7.4068945E-04 9.6438901E-02 4.2186734E-01 4.0420323E-01 1.6521354E-01 26 7.4761806E+00 -3.5725194E-05 4.1775499E-04 3.5119603E-03 6.4885529E-01 6.1256435E-01 2.5515352E-01 27 4.4604272E+00 2.9981514E-05 -3.6009396E-04 1.7200561E-03 2.6729838E-01 8.6978482E-02 2.1025234E-02 28 2.6411534E+00 -1.8981999E-05 2.2964207E-04 -1.0248293E-03 3.7387443E-02 -5.2465950E-01 -3.0895126E-01 29 1.5537526E+00 1.1358027E-05 -1.4001898E-04 5.9042409E-04 4.4188542E-04 -5.3245971E-01 -3.3027106E-01 30 9.0207730E-01 -6.6715010E-06 8.1157993E-05 -3.4286862E-04 5.0905175E-04 -2.1156057E-01 -6.7241618E-02 31 5.0791756E-01 3.1497323E-06 -3.9169058E-05 1.7072107E-04 -4.3035521E-04 -3.3758711E-02 3.0496240E-01 32 2.6603230E-01 -1.3896922E-06 1.7195793E-05 -7.2820754E-05 1.0718870E-04 -3.3508872E-03 5.0238707E-01 33 1.3325972E-01 6.0953666E-07 -7.5418518E-06 3.2932830E-05 -7.3690706E-05 -3.8141169E-04 3.3776717E-01 34 6.4549101E-02 -2.3116262E-07 2.8799631E-06 -1.2420101E-05 2.3690331E-05 -8.2583201E-05 7.4066691E-02 35 3.0167973E-02 5.9088293E-08 -7.3497618E-07 3.1912430E-06 -6.5093678E-06 5.2965014E-06 1.0864741E-03 2p+ 3p+ 4p+ 5p+ 6p+ 7p+ 1 8.9528327E+07 1.8508106E-07 -1.0656397E-07 5.9797010E-08 3.2328365E-08 1.4904629E-08 -4.4416919E-09 2 3.9254436E+07 6.2085529E-07 -3.5737788E-07 1.9974507E-07 1.0728284E-07 4.9204393E-08 -1.4645131E-08 3 1.6889040E+07 1.7765406E-06 -1.0237680E-06 5.7430432E-07 3.1023459E-07 1.4293204E-07 -4.2587773E-08 4 7.4319801E+06 4.5292544E-06 -2.6107903E-06 1.4607643E-06 7.8555981E-07 3.6063096E-07 -1.0736178E-07 5 3.3430260E+06 1.1492711E-05 -6.6340521E-06 3.7213990E-06 2.0089031E-06 9.2498210E-07 -2.7556530E-07 6 1.5331357E+06 2.8645563E-05 -1.6553372E-05 9.2716431E-06 4.9902808E-06 2.2922272E-06 -6.8249905E-07 7 7.1481868E+05 7.1299861E-05 -4.1289196E-05 2.3174915E-05 1.2507667E-05 5.7572786E-06 -1.7150423E-06 8 3.3842964E+05 1.7713732E-04 -1.0280329E-04 5.7660205E-05 3.1056352E-05 1.4270808E-05 -4.2494177E-06 9 1.6259215E+05 4.4126013E-04 -2.5691179E-04 1.4438732E-04 7.7939317E-05 3.5871933E-05 -1.0685601E-05 10 7.9242618E+04 1.1030766E-03 -6.4453021E-04 3.6221218E-04 1.9523853E-04 8.9743264E-05 -2.6724599E-05 11 3.9170466E+04 2.7638798E-03 -1.6226767E-03 9.1393406E-04 4.9358104E-04 2.2718334E-04 -6.7673739E-05 12 1.9647657E+04 6.8870130E-03 -4.0672466E-03 2.2925361E-03 1.2369438E-03 5.6876649E-04 -1.6938368E-04 13 1.0020777E+04 1.6792920E-02 -1.0002738E-02 5.6559756E-03 3.0579243E-03 1.4078437E-03 -4.1938690E-04 14 5.2109283E+03 3.9172814E-02 -2.3627285E-02 1.3396234E-02 7.2408005E-03 3.3310965E-03 -9.9211593E-04 15 2.7675752E+03 8.4648867E-02 -5.2031809E-02 2.9683875E-02 1.6092119E-02 7.4143305E-03 -2.2089703E-03 16 1.5014692E+03 1.6155103E-01 -1.0190795E-01 5.8520783E-02 3.1747075E-02 1.4618259E-02 -4.3544496E-03 17 8.3196656E+02 2.5339179E-01 -1.6448447E-01 9.5396357E-02 5.1997098E-02 2.3999120E-02 -7.1524235E-03 18 4.7044328E+02 2.9307388E-01 -1.8178700E-01 1.0288540E-01 5.5424654E-02 2.5445359E-02 -7.5750084E-03 19 2.7074129E+02 2.1588575E-01 -4.9998273E-02 6.9965115E-03 1.1036330E-04 -3.5011180E-04 1.2262730E-04 20 1.5872313E+02 8.1317210E-02 2.4504860E-01 -2.3411786E-01 -1.4701743E-01 -7.0612316E-02 2.1190740E-02 21 9.4890277E+01 1.1618436E-02 4.4906541E-01 -4.3107059E-01 -2.6877271E-01 -1.2809629E-01 3.8370628E-02 22 5.6801830E+01 4.8783558E-04 3.2919198E-01 -2.1972246E-01 -1.1856921E-01 -5.5304221E-02 1.6533368E-02 23 3.4091498E+01 -1.4692919E-04 9.5405797E-02 3.4502052E-01 3.5473792E-01 1.9485758E-01 -5.9851609E-02 24 2.0835533E+01 -2.0653445E-05 8.1628239E-03 5.9466018E-01 6.5752699E-01 3.6370616E-01 -1.1164664E-01 25 1.2557672E+01 -2.7140906E-06 2.3754601E-04 2.9428521E-01 9.8432827E-02 1.0100210E-02 -8.2837605E-04 26 7.4761806E+00 1.4709059E-05 -2.3681903E-04 4.4725421E-02 -6.0125596E-01 -4.9711713E-01 1.6335008E-01 27 4.4604272E+00 1.2124939E-06 -5.8606062E-05 2.9353192E-03 -5.4565693E-01 -4.9188064E-01 1.6561860E-01 28 2.6411534E+00 7.5735548E-07 1.5280158E-05 -4.4047480E-04 -1.6144274E-01 1.0389325E-01 -5.4330002E-02 29 1.5537526E+00 -1.0456431E-06 -5.8293096E-06 2.2335526E-04 -1.5346118E-02 5.4431412E-01 -2.4348945E-01 30 9.0207730E-01 -6.1784369E-08 1.1267487E-05 -2.0375643E-04 -9.0282861E-04 4.6050148E-01 -2.2852751E-01 31 5.0791756E-01 -1.8487396E-07 -3.6182006E-06 8.5160710E-05 1.3832501E-04 1.6868295E-01 -2.1828083E-02 32 2.6603230E-01 3.3818529E-08 2.0415540E-06 -3.8643012E-05 3.4546450E-05 2.2267922E-02 2.6838162E-01 33 1.3325972E-01 -4.9712613E-09 -1.0063682E-06 1.8651731E-05 3.4358506E-05 2.0210168E-03 4.4486495E-01 34 6.4549101E-02 1.5971227E-08 2.6341710E-07 -5.8658103E-06 1.1820816E-05 8.8252020E-04 3.6608515E-01 35 3.0167973E-02 1.1918494E-09 -1.1408669E-07 1.9740001E-06 4.9666793E-06 2.1027376E-04 1.0258037E-01 3d- 4d- 5d- 6d- 1 1.3935969E+06 8.9299523E-06 -5.4513178E-06 2.8680445E-06 -1.1341374E-06 2 3.1789037E+05 3.8063933E-05 -2.3239868E-05 1.2226989E-05 -4.8351129E-06 3 9.7293283E+04 1.3422972E-04 -8.2020571E-05 4.3165039E-05 -1.7070196E-05 4 3.5121936E+04 4.2384616E-04 -2.5924507E-04 1.3645944E-04 -5.3968762E-05 5 1.4225588E+04 1.2717580E-03 -7.7991666E-04 4.1086994E-04 -1.6252180E-04 6 6.2939990E+03 3.7323825E-03 -2.2963654E-03 1.2106855E-03 -4.7900166E-04 7 2.9922028E+03 1.0680359E-02 -6.6110028E-03 3.4918622E-03 -1.3820602E-03 8 1.5082068E+03 2.8901330E-02 -1.8020324E-02 9.5358033E-03 -3.7760775E-03 9 7.9626924E+02 7.1189337E-02 -4.4954351E-02 2.3879321E-02 -9.4638660E-03 10 4.3664660E+02 1.5102261E-01 -9.6288538E-02 5.1263492E-02 -2.0328566E-02 11 2.4637439E+02 2.5526300E-01 -1.6132428E-01 8.5716532E-02 -3.3973193E-02 12 1.4220393E+02 3.1518545E-01 -1.8056027E-01 9.2304613E-02 -3.6219537E-02 13 8.3336868E+01 2.4849836E-01 -4.0897012E-02 -2.4969447E-03 3.4350676E-03 14 4.9198353E+01 1.0796954E-01 2.4185786E-01 -1.9170451E-01 8.2487036E-02 15 2.9229199E+01 1.9665612E-02 4.3771370E-01 -3.3176430E-01 1.4225937E-01 16 1.7476321E+01 1.1665399E-03 3.2079229E-01 -1.2416686E-01 3.5040717E-02 17 1.0394349E+01 -1.3761994E-04 1.0197530E-01 3.2038480E-01 -1.9109390E-01 18 6.0764938E+00 -3.9222415E-05 1.1018472E-02 5.0523432E-01 -2.8960869E-01 19 3.5085826E+00 -4.7326729E-05 4.7083707E-04 2.9486166E-01 -7.3773547E-02 20 1.9769630E+00 8.6618975E-06 -3.5255269E-05 6.7379743E-02 2.9102556E-01 21 1.0814289E+00 -7.4816696E-06 2.1781272E-05 4.2740586E-03 4.5192554E-01 22 5.7122110E-01 2.9475419E-06 -7.6833099E-06 1.7935956E-04 3.3017568E-01 23 2.8647155E-01 -1.2420189E-06 6.0174970E-06 -1.0340082E-04 1.1910353E-01 24 1.2659727E-01 2.6420813E-07 -6.6246115E-07 -4.6558788E-07 1.1991058E-02 3d+ 4d+ 5d+ 6d+ 1 1.3935969E+06 1.4314612E-07 -8.8303771E-08 4.6300971E-08 -1.7680877E-08 2 3.1789037E+05 1.4826394E-06 -9.1360983E-07 4.7943182E-07 -1.8334297E-07 3 9.7293283E+04 1.0830664E-05 -6.6922917E-06 3.5119630E-06 -1.3419202E-06 4 3.5121936E+04 6.4536928E-05 -3.9897855E-05 2.0951163E-05 -8.0113244E-06 5 1.4225588E+04 3.2921281E-04 -2.0409049E-04 1.0721409E-04 -4.0982672E-05 6 6.2939990E+03 1.4669189E-03 -9.1150767E-04 4.7928352E-04 -1.8330600E-04 7 2.9922028E+03 5.7047449E-03 -3.5630240E-03 1.8757400E-03 -7.1739915E-04 8 1.5082068E+03 1.9157841E-02 -1.2046111E-02 6.3547271E-03 -2.4321449E-03 9 7.9626924E+02 5.4622905E-02 -3.4783314E-02 1.8412273E-02 -7.0510230E-03 10 4.3664660E+02 1.2848036E-01 -8.2912271E-02 4.4055047E-02 -1.6888937E-02 11 2.4637439E+02 2.3669407E-01 -1.5267592E-01 8.1123431E-02 -3.1092809E-02 12 1.4220393E+02 3.1785236E-01 -1.9291481E-01 1.0031669E-01 -3.8253725E-02 13 8.3336868E+01 2.7364788E-01 -8.4948988E-02 2.6131011E-02 -8.1898717E-03 14 4.9198353E+01 1.3213455E-01 1.9095670E-01 -1.5651119E-01 6.5271714E-02 15 2.9229199E+01 2.7847683E-02 4.3188967E-01 -3.3090906E-01 1.3739760E-01 16 1.7476321E+01 1.9450203E-03 3.5848452E-01 -1.8586989E-01 6.4057493E-02 17 1.0394349E+01 -7.7081710E-05 1.2922899E-01 2.5576553E-01 -1.4958346E-01 18 6.0764938E+00 -7.6089574E-05 1.6844193E-02 5.0964602E-01 -2.8297479E-01 19 3.5085826E+00 -4.8207009E-05 7.9365646E-04 3.4042731E-01 -1.2754495E-01 20 1.9769630E+00 2.6448192E-06 4.8906910E-05 9.0084508E-02 2.2752536E-01 21 1.0814289E+00 -5.0370346E-06 -1.4721697E-05 7.4118458E-03 4.4235687E-01 22 5.7122110E-01 2.1320920E-06 -3.8720730E-07 4.4035456E-04 3.6881499E-01 23 2.8647155E-01 -8.6625640E-07 1.4163186E-06 -9.0544536E-05 1.5748603E-01 24 1.2659727E-01 1.6599872E-07 7.1577439E-07 -1.4698908E-05 2.3640050E-02 4f- 5f- 1 7.5696613E+03 7.5983539E-05 -3.8640986E-05 2 2.4109604E+03 5.8074883E-04 -2.9712253E-04 3 9.9391221E+02 3.2678936E-03 -1.6697182E-03 4 4.6727769E+02 1.4473842E-02 -7.4501359E-03 5 2.3879068E+02 4.8691061E-02 -2.5061547E-02 6 1.2828739E+02 1.2588787E-01 -6.5331938E-02 7 7.1474419E+01 2.4181543E-01 -1.2176975E-01 8 4.0508322E+01 3.3025445E-01 -1.5187905E-01 9 2.3278551E+01 2.9721677E-01 -7.3438228E-02 10 1.3373065E+01 1.5334333E-01 1.5652386E-01 11 7.5576700E+00 3.6538962E-02 3.6739695E-01 12 4.2169552E+00 2.4753190E-03 3.7856877E-01 13 2.2998596E+00 1.1620581E-04 2.1437293E-01 14 1.1952368E+00 -7.1667000E-05 5.9826500E-02 15 5.3507461E-01 5.6342200E-06 4.9741382E-03 16 2.0355074E-01 -3.4753329E-06 -2.3900493E-05 4f+ 5f+ 1 7.5696613E+03 2.7077468E-05 -1.3666836E-05 2 2.4109604E+03 3.3741785E-04 -1.7195743E-04 3 9.9391221E+02 2.4071740E-03 -1.2233814E-03 4 4.6727769E+02 1.1991211E-02 -6.1419861E-03 5 2.3879068E+02 4.3497406E-02 -2.2281408E-02 6 1.2828739E+02 1.1775801E-01 -6.0848366E-02 7 7.1474419E+01 2.3282857E-01 -1.1736353E-01 8 4.0508322E+01 3.2858585E-01 -1.5239420E-01 9 2.3278551E+01 3.0561533E-01 -8.4477261E-02 10 1.3373065E+01 1.6339199E-01 1.3784874E-01 11 7.5576700E+00 4.1102595E-02 3.5838536E-01 12 4.2169552E+00 3.0438296E-03 3.8510927E-01 13 2.2998596E+00 1.5854449E-04 2.2810387E-01 14 1.1952368E+00 -8.3704491E-05 6.8658960E-02 15 5.3507461E-01 7.9948371E-06 6.3869552E-03 16 2.0355074E-01 -4.5144163E-06 -4.0773758E-05 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 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-2.5181039E-02 1.6182214E-02 -8.5890484E-03 3.2919113E-03 11 2.4637439E+02 -3.5378858E-02 2.2743028E-02 -1.2074051E-02 4.6268175E-03 12 1.4220393E+02 -3.6442362E-02 2.2074898E-02 -1.1477064E-02 4.3765159E-03 13 8.3336868E+01 -2.4150195E-02 7.5392829E-03 -2.3488576E-03 7.4126189E-04 14 4.9198353E+01 -8.9817562E-03 -1.2849948E-02 1.0527905E-02 -4.3899750E-03 15 2.9229199E+01 -1.4620969E-03 -2.2516923E-02 1.7239363E-02 -7.1571478E-03 16 1.7476321E+01 -7.8341440E-05 -1.4478450E-02 7.5107159E-03 -2.5904693E-03 17 1.0394349E+01 2.0487205E-06 -4.0265615E-03 -7.9507210E-03 4.6493489E-03 18 6.0764938E+00 2.0233158E-06 -4.0182086E-04 -1.2126413E-02 6.7317625E-03 19 3.5085826E+00 7.5205878E-07 -1.4133440E-05 -6.1571676E-03 2.3070304E-03 20 1.9769630E+00 2.9050794E-08 -7.8675043E-07 -1.2229875E-03 -3.0877472E-03 21 1.0814289E+00 1.7789314E-08 2.0940872E-07 -7.4481072E-05 -4.4406261E-03 22 5.7122110E-01 -5.5463914E-10 -2.5182979E-08 -3.1888984E-06 -2.6909277E-03 23 2.8647155E-01 -1.2298105E-09 3.2936040E-09 4.5861549E-07 -8.1371840E-04 24 1.2659727E-01 9.1377246E-10 -5.2143892E-09 5.2908963E-08 -8.1200764E-05 4f- 5f- 1 7.5696613E+03 -3.1759423E-05 1.6120417E-05 2 2.4109604E+03 -2.1228358E-04 1.0874262E-04 3 9.9391221E+02 -9.3352792E-04 4.7689967E-04 4 4.6727769E+02 -3.1147141E-03 1.6036633E-03 5 2.3879068E+02 -7.8498033E-03 4.0406696E-03 6 1.2828739E+02 -1.5226796E-02 7.9041614E-03 7 7.1474419E+01 -2.2091423E-02 1.1130776E-02 8 4.0508322E+01 -2.2856027E-02 1.0520508E-02 9 2.3278551E+01 -1.5637781E-02 3.8763075E-03 10 1.3373065E+01 -6.1178818E-03 -6.2463226E-03 11 7.5576700E+00 -1.0911433E-03 -1.1042812E-02 12 4.2169552E+00 -5.2286237E-05 -8.5040889E-03 13 2.2998596E+00 -6.5354554E-07 -3.5569201E-03 14 1.1952368E+00 1.3065928E-06 -7.1526863E-04 15 5.3507461E-01 9.7207726E-08 -3.9615693E-05 16 2.0355074E-01 4.9314340E-08 1.7227155E-07 4f+ 5f+ 1 7.5696613E+03 -1.9130429E-05 9.6314449E-06 2 2.4109604E+03 -1.5566063E-04 7.9270887E-05 3 9.9391221E+02 -7.6477227E-04 3.8818970E-04 4 4.6727769E+02 -2.7148476E-03 1.3892320E-03 5 2.3879068E+02 -7.1847034E-03 3.6769296E-03 6 1.2828739E+02 -1.4425278E-02 7.4483328E-03 7 7.1474419E+01 -2.1428351E-02 1.0795187E-02 8 4.0508322E+01 -2.2838738E-02 1.0589203E-02 9 2.3278551E+01 -1.6135362E-02 4.4654107E-03 10 1.3373065E+01 -6.5434944E-03 -5.5073591E-03 11 7.5576700E+00 -1.2382425E-03 -1.0779136E-02 12 4.2169552E+00 -6.8344458E-05 -8.6557899E-03 13 2.2998596E+00 -2.7058957E-06 -3.7866914E-03 14 1.1952368E+00 1.0316881E-06 -8.2173684E-04 15 5.3507461E-01 -7.3570754E-08 -5.1139838E-05 16 2.0355074E-01 2.4849354E-08 2.0008074E-07 ** Uus 292 ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2592404E+07 2.1354002E-03 -1.0272007E-03 5.1253312E-04 -2.7771728E-04 -1.5250522E-04 7.9005541E-05 3.3322696E-05 2 1.3978664E+07 4.6625671E-03 -2.2583138E-03 1.1282757E-03 -6.1156756E-04 -3.3587017E-04 1.7400331E-04 7.3391127E-05 3 4.7485662E+06 8.3223035E-03 -4.0621431E-03 2.0324385E-03 -1.1020768E-03 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5.6942178E-01 2.2457171E-06 -2.8767955E-05 1.1122496E-04 -3.1491320E-04 -3.8723203E-02 3.1649666E-01 32 3.0195650E-01 -9.9683905E-07 1.2674151E-05 -4.6196964E-05 3.6135035E-05 -3.8609106E-03 5.1617418E-01 33 1.5252401E-01 4.3624947E-07 -5.5190819E-06 2.1424803E-05 -4.7710557E-05 -4.6124868E-04 3.3522198E-01 34 7.3830413E-02 -1.5779288E-07 2.0250444E-06 -7.6048312E-06 1.1119365E-05 -1.0560186E-04 6.8808867E-02 35 3.4331197E-02 4.0001929E-08 -5.1122770E-07 1.9473662E-06 -3.3533274E-06 7.3682588E-06 7.4983881E-04 2p+ 3p+ 4p+ 5p+ 6p+ 7p+ 1 8.9324682E+07 1.9844275E-07 -1.1452131E-07 6.4383561E-08 3.4913976E-08 -1.6298790E-08 -5.1314179E-09 2 3.8971244E+07 6.6648187E-07 -3.8465789E-07 2.1553830E-07 1.1636513E-07 -5.4182195E-08 -1.7048598E-08 3 1.6694350E+07 1.9115713E-06 -1.1041950E-06 6.2064429E-07 3.3638191E-07 -1.5697947E-07 -4.9418810E-08 4 7.3155498E+06 4.8908670E-06 -2.8266153E-06 1.5853781E-06 8.5667855E-07 -3.9908212E-07 -1.2558587E-07 5 3.2771361E+06 1.2449468E-05 -7.2039556E-06 4.0494353E-06 2.1938402E-06 -1.0235102E-06 -3.2219097E-07 6 1.4973698E+06 3.1103651E-05 -1.8021340E-05 1.0117993E-05 5.4708924E-06 -2.5493986E-06 -8.0231584E-07 7 6.9607021E+05 7.7525241E-05 -4.5009112E-05 2.5316902E-05 1.3715100E-05 -6.3979046E-06 -2.0139407E-06 8 3.2875270E+05 1.9287296E-04 -1.1224157E-04 6.3104138E-05 3.4141337E-05 -1.5913425E-05 -5.0083245E-06 9 1.5754465E+05 4.8176387E-04 -2.8125503E-04 1.5841750E-04 8.5843002E-05 -4.0045162E-05 -1.2605440E-05 10 7.6517657E+04 1.2102637E-03 -7.0922034E-04 3.9953322E-04 2.1631365E-04 -1.0084909E-04 -3.1741041E-05 11 3.7655472E+04 3.0488817E-03 -1.7953542E-03 1.0135175E-03 5.4951923E-04 -2.5637796E-04 -8.0704291E-05 12 1.8802319E+04 7.6265881E-03 -4.5189268E-03 2.5535814E-03 1.3839205E-03 -6.4540138E-04 -2.0314369E-04 13 9.5490048E+03 1.8646698E-02 -1.1147317E-02 6.3189288E-03 3.4301268E-03 -1.6008181E-03 -5.0394265E-04 14 4.9436064E+03 4.3546926E-02 -2.6379926E-02 1.4999518E-02 8.1442201E-03 -3.8000924E-03 -1.1962115E-03 15 2.6131537E+03 9.3700064E-02 -5.7890589E-02 3.3123863E-02 1.8031858E-02 -8.4220445E-03 -2.6516637E-03 16 1.4114600E+03 1.7604571E-01 -1.1173986E-01 6.4390917E-02 3.5099550E-02 -1.6394461E-02 -5.1616594E-03 17 7.7969409E+02 2.6677650E-01 -1.7373276E-01 1.0098564E-01 5.5254645E-02 -2.5847030E-02 -8.1401804E-03 18 4.4015329E+02 2.9072479E-01 -1.7442256E-01 9.7330046E-02 5.2377616E-02 -2.4361136E-02 -7.6636863E-03 19 2.5330674E+02 1.9525414E-01 -1.0601129E-02 -2.2983471E-02 -1.7757196E-02 8.9581070E-03 2.8570145E-03 20 1.4899547E+02 6.3861501E-02 2.9384224E-01 -2.7982425E-01 -1.7647910E-01 8.5877312E-02 2.7237379E-02 21 8.9579212E+01 7.9329938E-03 4.4345556E-01 -4.2402553E-01 -2.6468573E-01 1.2798843E-01 4.0536927E-02 22 5.4394369E+01 3.2643245E-05 2.8640751E-01 -1.5466490E-01 -7.2719201E-02 3.2819405E-02 1.0281321E-02 23 3.3714421E+01 8.5829641E-05 7.6931370E-02 3.5964409E-01 3.7148146E-01 -2.0742761E-01 -6.7443358E-02 24 2.1316316E+01 -2.0361348E-04 8.9106518E-03 5.5288857E-01 6.1621004E-01 -3.4683724E-01 -1.1274527E-01 25 1.3296603E+01 1.3139072E-04 -4.5427731E-04 2.9921988E-01 1.3998367E-01 -3.9531857E-02 -1.0641840E-02 26 8.1370355E+00 -7.7105236E-05 2.0380672E-04 5.6971542E-02 -5.3231430E-01 4.4670480E-01 1.5556529E-01 27 4.9491723E+00 6.1882386E-05 -3.3722709E-04 3.8082277E-03 -5.8477483E-01 5.4028252E-01 1.9347877E-01 28 2.9526792E+00 -3.5896446E-05 1.6616830E-04 -8.8932262E-05 -2.0811751E-01 -7.8526734E-03 -1.9136134E-02 29 1.7419261E+00 2.0587222E-05 -9.2351548E-05 3.6455444E-05 -2.2483682E-02 -5.3631225E-01 -2.5590533E-01 30 1.0089245E+00 -1.1981392E-05 5.8729827E-05 -1.1210137E-04 -1.5830009E-03 -5.0160205E-01 -2.6694430E-01 31 5.6942178E-01 5.6268482E-06 -2.6386879E-05 3.7825392E-05 3.1579811E-04 -1.9046597E-01 -3.8625781E-02 32 3.0195650E-01 -2.5388113E-06 1.2125077E-05 -1.7931131E-05 -3.0963819E-05 -2.6582303E-02 2.7497196E-01 33 1.5252401E-01 1.0930787E-06 -5.3300822E-06 1.0361472E-05 7.8772426E-05 -2.5768919E-03 4.5478979E-01 34 7.3830413E-02 -3.8882191E-07 1.8099322E-06 -1.8887804E-06 5.6698869E-06 -1.1726961E-03 3.6582046E-01 35 3.4331197E-02 1.0508462E-07 -5.2233339E-07 1.1721940E-06 9.8094631E-06 -2.6799604E-04 9.9011241E-02 3d- 4d- 5d- 6d- 1 1.3229736E+06 1.0056284E-05 -6.1568510E-06 3.2580632E-06 -1.3209644E-06 2 3.0141057E+05 4.2800213E-05 -2.6207592E-05 1.3866735E-05 -5.6215883E-06 3 9.2387675E+04 1.5056792E-04 -9.2279535E-05 4.8849799E-05 -1.9808250E-05 4 3.3363114E+04 4.7644874E-04 -2.9229339E-04 1.5472419E-04 -6.2729412E-05 5 1.3513413E+04 1.4328179E-03 -8.8151040E-04 4.6718786E-04 -1.8950280E-04 6 5.9828890E+03 4.2096709E-03 -2.5985246E-03 1.3777531E-03 -5.5876952E-04 7 2.8477309E+03 1.2017457E-02 -7.4657966E-03 3.9679028E-03 -1.6106219E-03 8 1.4369726E+03 3.2324430E-02 -2.0232597E-02 1.0768566E-02 -4.3711938E-03 9 7.5924995E+02 7.8779998E-02 -4.9970281E-02 2.6717970E-02 -1.0861210E-02 10 4.1648189E+02 1.6389603E-01 -1.0477733E-01 5.6080599E-02 -2.2792756E-02 11 2.3490804E+02 2.6854060E-01 -1.6951253E-01 9.0541845E-02 -3.6804683E-02 12 1.3558587E+02 3.1555766E-01 -1.7445094E-01 8.7932002E-02 -3.5138157E-02 13 7.9342888E+01 2.3230933E-01 -7.1467583E-03 -2.5268346E-02 1.3246001E-02 14 4.6730388E+01 9.0796494E-02 2.8292947E-01 -2.2285643E-01 9.8563104E-02 15 2.7854869E+01 1.3872703E-02 4.3967619E-01 -3.3069094E-01 1.4446719E-01 16 1.6665360E+01 8.7743070E-04 2.8780793E-01 -6.2717643E-02 3.6645225E-03 17 9.9036870E+00 -2.4571010E-04 7.9760343E-02 3.7232280E-01 -2.2634635E-01 18 5.8232484E+00 2.4373551E-05 7.1649300E-03 4.9011288E-01 -2.8552881E-01 19 3.3874808E+00 -7.3516486E-05 3.7362573E-04 2.5422395E-01 -2.6332215E-02 20 1.9331291E+00 2.6460214E-05 -5.7653890E-05 5.1829379E-02 3.2979017E-01 21 1.0691248E+00 -1.5644209E-05 2.8373007E-05 3.0379311E-03 4.5250190E-01 22 5.6984084E-01 6.4512082E-06 -6.8034669E-06 -9.0806917E-06 3.0015617E-01 23 2.8748542E-01 -2.4919746E-06 6.2111930E-06 -7.5330887E-05 9.3985391E-02 24 1.2603693E-01 5.4440510E-07 -6.2428968E-07 -8.2547013E-06 7.5280108E-03 3d+ 4d+ 5d+ 6d+ 1 1.3229736E+06 1.6623838E-07 -1.0297172E-07 5.4457130E-08 -2.1454225E-08 2 3.0141057E+05 1.7201462E-06 -1.0627705E-06 5.6020664E-07 -2.2025724E-07 3 9.2387675E+04 1.2531700E-05 -7.7720936E-06 4.1083612E-06 -1.6177253E-06 4 3.3363114E+04 7.4712630E-05 -4.6329451E-05 2.4458473E-05 -9.6222069E-06 5 1.3513413E+04 3.8067104E-04 -2.3685636E-04 1.2527554E-04 -4.9327943E-05 6 5.9828890E+03 1.6896725E-03 -1.0534951E-03 5.5712567E-04 -2.1928899E-04 7 2.8477309E+03 6.5227040E-03 -4.0900949E-03 2.1677196E-03 -8.5390712E-04 8 1.4369726E+03 2.1678875E-02 -1.3686721E-02 7.2639724E-03 -2.8616504E-03 9 7.5924995E+02 6.0965825E-02 -3.9018288E-02 2.0799474E-02 -8.2043672E-03 10 4.1648189E+02 1.4051935E-01 -9.1022847E-02 4.8652279E-02 -1.9197867E-02 11 2.3490804E+02 2.5129936E-01 -1.6231161E-01 8.6790121E-02 -3.4262706E-02 12 1.3558587E+02 3.2182607E-01 -1.9120977E-01 9.8857071E-02 -3.8660280E-02 13 7.9342888E+01 2.5957774E-01 -5.5958648E-02 6.7836897E-03 -4.1193602E-04 14 4.6730388E+01 1.1351746E-01 2.3434153E-01 -1.8859135E-01 8.1035027E-02 15 2.7854869E+01 2.0289322E-02 4.4255514E-01 -3.3917996E-01 1.4458646E-01 16 1.6665360E+01 1.4917486E-03 3.2762754E-01 -1.3232783E-01 3.9021281E-02 17 9.9036870E+00 -2.6720101E-04 1.0381836E-01 3.1410184E-01 -1.8597638E-01 18 5.8232484E+00 2.7321207E-05 1.1355356E-02 5.0492265E-01 -2.8933802E-01 19 3.3874808E+00 -9.7269376E-05 7.0310788E-04 2.9919490E-01 -8.8052201E-02 20 1.9331291E+00 3.4546498E-05 -5.1950068E-05 7.1191583E-02 2.7147412E-01 21 1.0691248E+00 -1.9938759E-05 2.1765944E-05 5.5331518E-03 4.5302021E-01 22 5.6984084E-01 8.7300115E-06 -1.3886595E-05 2.0792327E-04 3.4160298E-01 23 2.8748542E-01 -3.2412795E-06 7.1838921E-06 -7.3316106E-05 1.2750735E-01 24 1.2603693E-01 7.0441009E-07 -4.1652689E-07 -2.5891686E-05 1.6191708E-02 4f- 5f- 1 7.8705299E+03 7.4839321E-05 -3.8549433E-05 2 2.5020499E+03 5.6940181E-04 -2.9506945E-04 3 1.0299379E+03 3.1987962E-03 -1.6554601E-03 4 4.8369691E+02 1.4182019E-02 -7.3941278E-03 5 2.4699623E+02 4.7882011E-02 -2.4963994E-02 6 1.3263515E+02 1.2434295E-01 -6.5368753E-02 7 7.3889268E+01 2.4015579E-01 -1.2258967E-01 8 4.1894295E+01 3.2970309E-01 -1.5386066E-01 9 2.4098604E+01 2.9844355E-01 -7.5946873E-02 10 1.3870684E+01 1.5514265E-01 1.5529855E-01 11 7.8660404E+00 3.7462569E-02 3.6746109E-01 12 4.4199098E+00 2.6215212E-03 3.7671875E-01 13 2.4438504E+00 1.2984711E-04 2.1270510E-01 14 1.2954819E+00 -7.5623913E-05 6.0772142E-02 15 5.8728545E-01 5.8032990E-06 5.2111018E-03 16 2.2777031E-01 -3.5750129E-06 -5.3131180E-05 4f+ 5f+ 1 7.8705299E+03 2.6130554E-05 -1.3364264E-05 2 2.5020499E+03 3.2635941E-04 -1.6853786E-04 3 1.0299379E+03 2.3369735E-03 -1.2035149E-03 4 4.8369691E+02 1.1689599E-02 -6.0672479E-03 5 2.4699623E+02 4.2638899E-02 -2.2133884E-02 6 1.3263515E+02 1.1609486E-01 -6.0793213E-02 7 7.3889268E+01 2.3096756E-01 -1.1807557E-01 8 4.1894295E+01 3.2786867E-01 -1.5437927E-01 9 2.4098604E+01 3.0688300E-01 -8.7247597E-02 10 1.3870684E+01 1.6539550E-01 1.3626071E-01 11 7.8660404E+00 4.2187183E-02 3.5833446E-01 12 4.4199098E+00 3.2242205E-03 3.8333454E-01 13 2.4438504E+00 1.7685026E-04 2.2644468E-01 14 1.2954819E+00 -8.9172288E-05 6.9703965E-02 15 5.8728545E-01 8.5609058E-06 6.6290644E-03 16 2.2777031E-01 -4.6858800E-06 -8.2534651E-05 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2592404E+07 -1.9436199E-03 9.3121586E-04 -4.6428810E-04 2.5152536E-04 1.3811373E-04 -7.1548756E-05 -3.0177436E-05 2 1.3978664E+07 -6.1749308E-03 2.9591735E-03 -1.4754577E-03 7.9933099E-04 4.3891940E-04 -2.2737876E-04 -9.5902874E-05 3 4.7485662E+06 -1.0804212E-02 5.1854322E-03 -2.5862644E-03 1.4012219E-03 7.6943772E-04 -3.9860486E-04 -1.6812144E-04 4 1.7811678E+06 -1.7812550E-02 8.5605889E-03 -4.2708167E-03 2.3140783E-03 1.2707426E-03 -6.5830675E-04 -2.7765948E-04 5 7.3153250E+05 -2.6353919E-02 1.2689444E-02 -6.3333811E-03 3.4320300E-03 1.8846946E-03 -9.7637857E-04 -4.1181199E-04 6 3.1773186E+05 -3.8184776E-02 1.8425197E-02 -9.2007853E-03 4.9865871E-03 2.7385402E-03 -1.4187276E-03 -5.9839478E-04 7 1.4557095E+05 -5.2055535E-02 2.5196171E-02 -1.2592672E-02 6.8264543E-03 3.7491390E-03 -1.9423399E-03 -8.1923061E-04 8 6.9383090E+04 -6.8892789E-02 3.3488867E-02 -1.6757840E-02 9.0876528E-03 4.9917282E-03 -2.5861395E-03 -1.0908157E-03 9 3.4369147E+04 -8.5307953E-02 4.1729172E-02 -2.0924683E-02 1.1353700E-02 6.2371861E-03 -3.2316454E-03 -1.3630269E-03 10 1.7596622E+04 -9.9013362E-02 4.8814595E-02 -2.4543878E-02 1.3328217E-02 7.3243999E-03 -3.7950703E-03 -1.6008475E-03 11 9.3292167E+03 -1.0175383E-01 5.0348782E-02 -2.5374822E-02 1.3787284E-02 7.5765193E-03 -3.9262737E-03 -1.6558824E-03 12 5.1287822E+03 -8.9656730E-02 4.3044267E-02 -2.1493195E-02 1.1647146E-02 6.3985360E-03 -3.3140932E-03 -1.3984036E-03 13 2.9810020E+03 -5.7356921E-02 2.1889682E-02 -9.8956497E-03 5.1765056E-03 2.8014372E-03 -1.4482565E-03 -6.0841788E-04 14 2.0043865E+03 -2.4663737E-02 3.3622743E-03 2.4655543E-04 -4.5996002E-04 -2.9045715E-04 1.6442703E-04 6.5821895E-05 15 1.4317046E+03 -1.8168199E-02 -1.4958923E-02 1.3232296E-02 -8.2483821E-03 -4.7470460E-03 2.4837063E-03 1.0561262E-03 16 8.8476322E+02 -7.2089276E-03 -4.2523931E-02 3.6373777E-02 -2.2750072E-02 -1.3025934E-02 6.8435087E-03 2.8895288E-03 17 5.4604920E+02 -4.9310157E-05 -5.0315875E-02 4.7694763E-02 -3.1010174E-02 -1.8049378E-02 9.5007521E-03 4.0311275E-03 18 3.4698710E+02 -6.3656205E-04 -3.3208726E-02 3.5331415E-02 -2.3767349E-02 -1.3907522E-02 7.3665687E-03 3.1094256E-03 19 2.2649864E+02 5.3470971E-04 -1.4076657E-02 4.8040966E-03 -1.3145112E-03 -5.7591509E-04 2.4606734E-04 1.1852206E-04 20 1.4472710E+02 -4.7912729E-04 -2.7376695E-03 -2.7505333E-02 3.1728351E-02 2.2231527E-02 -1.2355138E-02 -5.3279187E-03 21 9.5774498E+01 4.5267861E-04 -2.2741465E-04 -3.1521262E-02 4.2088209E-02 3.0508695E-02 -1.7224410E-02 -7.3665157E-03 22 6.4200143E+01 -3.8831648E-04 6.4513790E-05 -1.6982353E-02 2.3789357E-02 1.7782289E-02 -1.0100172E-02 -4.4170084E-03 23 4.3351340E+01 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3.0987944E-03 -1.9162990E-03 1.0219323E-03 -4.2398228E-04 7 3.6101516E+03 8.7523420E-03 -5.4408464E-03 2.9044580E-03 -1.2047909E-03 8 1.8111322E+03 2.3698123E-02 -1.4836106E-02 7.9397955E-03 -3.2969862E-03 9 9.5119131E+02 5.9247229E-02 -3.7504152E-02 2.0123042E-02 -8.3573298E-03 10 5.1908916E+02 1.2977322E-01 -8.3107515E-02 4.4765295E-02 -1.8618835E-02 11 2.9204020E+02 2.3119094E-01 -1.4750052E-01 7.9287118E-02 -3.2938674E-02 12 1.6811751E+02 3.0936348E-01 -1.8592118E-01 9.8008836E-02 -4.0550525E-02 13 9.8506390E+01 2.7382727E-01 -9.0187508E-02 3.0259106E-02 -1.0506018E-02 14 5.8153603E+01 1.4025309E-01 1.7559431E-01 -1.4879799E-01 6.7708076E-02 15 3.4346492E+01 3.2304170E-02 4.2219077E-01 -3.2840740E-01 1.4889883E-01 16 2.0516044E+01 2.1060923E-03 3.6823006E-01 -2.0499193E-01 7.8685440E-02 17 1.2203608E+01 5.2472783E-05 1.4069406E-01 2.4569209E-01 -1.6295521E-01 18 7.1058128E+00 -1.3773324E-04 1.8777960E-02 5.1829235E-01 -3.1842417E-01 19 4.0994313E+00 -5.1443398E-06 6.6490619E-04 3.4517109E-01 -1.3186079E-01 20 2.3166074E+00 -1.7539342E-05 1.2792473E-06 8.8156849E-02 2.7275360E-01 21 1.2738921E+00 4.7810772E-06 1.5702721E-05 6.0150011E-03 4.7533705E-01 22 6.7701115E-01 -2.8302547E-06 -1.5766157E-06 1.3427260E-04 3.4303222E-01 23 3.4032476E-01 7.2620730E-07 6.6249085E-06 -1.5139172E-04 1.1420470E-01 24 1.4828610E-01 -2.2375952E-07 -3.5471782E-07 -1.6961134E-06 9.8239856E-03 3d+ 4d+ 5d+ 6d+ 1 1.7146515E+06 1.1195863E-07 -6.9510553E-08 3.6740379E-08 -1.4727059E-08 2 3.9002835E+05 1.1444354E-06 -7.0987820E-07 3.7797642E-07 -1.5320750E-07 3 1.1920657E+05 8.2609024E-06 -5.1330413E-06 2.7214286E-06 -1.0966258E-06 4 4.2898801E+04 4.8838736E-05 -3.0392482E-05 1.6172005E-05 -6.5407854E-06 5 1.7301116E+04 2.4841429E-04 -1.5486125E-04 8.2254454E-05 -3.3193603E-05 6 7.6240437E+03 1.1065414E-03 -6.9180182E-04 3.6838242E-04 -1.4893742E-04 7 3.6101516E+03 4.3407123E-03 -2.7246370E-03 1.4504988E-03 -5.8584764E-04 8 1.8111322E+03 1.4882584E-02 -9.4036495E-03 5.0213176E-03 -2.0310971E-03 9 9.5119131E+02 4.3778934E-02 -2.7957105E-02 1.4958187E-02 -6.0493359E-03 10 5.1908916E+02 1.0741057E-01 -6.9598352E-02 3.7429811E-02 -1.5165606E-02 11 2.9204020E+02 2.0960190E-01 -1.3625700E-01 7.3258748E-02 -2.9658849E-02 12 1.6811751E+02 3.0586968E-01 -1.9219322E-01 1.0240446E-01 -4.1407043E-02 13 9.8506390E+01 2.9591208E-01 -1.2886082E-01 5.5632769E-02 -2.1035497E-02 14 5.8153603E+01 1.6802814E-01 1.1939546E-01 -1.1034357E-01 4.9392994E-02 15 3.4346492E+01 4.4554385E-02 4.0235189E-01 -3.1532636E-01 1.3927272E-01 16 2.0516044E+01 3.5146694E-03 4.0263200E-01 -2.5876084E-01 1.0431912E-01 17 1.2203608E+01 2.3968321E-04 1.7445762E-01 1.7012320E-01 -1.1635342E-01 18 7.1058128E+00 -2.3031840E-04 2.8031568E-02 5.0919805E-01 -3.0395252E-01 19 4.0994313E+00 2.3745468E-05 1.1201641E-03 3.9220788E-01 -1.8599068E-01 20 2.3166074E+00 -4.2598763E-05 1.7923917E-04 1.1626050E-01 2.0299438E-01 21 1.2738921E+00 1.7072425E-05 -6.7279250E-05 1.0500117E-02 4.6554727E-01 22 6.7701115E-01 -7.8836410E-06 2.1634072E-05 4.6245164E-04 3.8326486E-01 23 3.4032476E-01 2.6692796E-06 -4.4173883E-06 -1.3590419E-04 1.5041430E-01 24 1.4828610E-01 -7.0105787E-07 2.8758841E-06 -2.8435949E-05 2.0120320E-02 4f- 5f- 1 8.1055050E+03 7.5036875E-05 -3.9128000E-05 2 2.5752043E+03 5.6729401E-04 -2.9757704E-04 3 1.0597230E+03 3.1742292E-03 -1.6630091E-03 4 4.9773588E+02 1.4037857E-02 -7.4089930E-03 5 2.5431382E+02 4.7345165E-02 -2.4989462E-02 6 1.3671263E+02 1.2299082E-01 -6.5458047E-02 7 7.6260821E+01 2.3825158E-01 -1.2318980E-01 8 4.3298291E+01 3.2876324E-01 -1.5558006E-01 9 2.4936486E+01 2.9970556E-01 -7.8450801E-02 10 1.4373377E+01 1.5701480E-01 1.5430874E-01 11 8.1719534E+00 3.8292268E-02 3.6823395E-01 12 4.6189096E+00 2.7456681E-03 3.7499551E-01 13 2.5863476E+00 1.4232701E-04 2.1055851E-01 14 1.3957268E+00 -7.9136568E-05 6.1455952E-02 15 6.3932727E-01 6.2183199E-06 5.4001927E-03 16 2.6314772E-01 -3.8919742E-06 -8.4232763E-05 4f+ 5f+ 1 8.1055050E+03 2.5787403E-05 -1.3357876E-05 2 2.5752043E+03 3.2163093E-04 -1.6819375E-04 3 1.0597230E+03 2.3029524E-03 -1.2011223E-03 4 4.9773588E+02 1.1519571E-02 -6.0548646E-03 5 2.5431382E+02 4.2042460E-02 -2.2103393E-02 6 1.3671263E+02 1.1463120E-01 -6.0793320E-02 7 7.6260821E+01 2.2888489E-01 -1.1857924E-01 8 4.3298291E+01 3.2676876E-01 -1.5609802E-01 9 2.4936486E+01 3.0818215E-01 -9.0013290E-02 10 1.4373377E+01 1.6748494E-01 1.3488452E-01 11 8.1719534E+00 4.3174529E-02 3.5899622E-01 12 4.6189096E+00 3.3787267E-03 3.8171622E-01 13 2.5863476E+00 1.9400621E-04 2.2433154E-01 14 1.3957268E+00 -9.4293830E-05 7.0475489E-02 15 6.3932727E-01 9.5405261E-06 6.8205527E-03 16 2.6314772E-01 -5.1636230E-06 -1.2858460E-04 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 7s+ 1 5.2485475E+07 -2.0555311E-03 9.9107491E-04 -4.9431851E-04 2.6807867E-04 1.4764647E-04 -7.7120886E-05 3.3184694E-05 2 1.3949578E+07 -6.5169522E-03 3.1428629E-03 -1.5676398E-03 8.5017234E-04 4.6824333E-04 -2.4458086E-04 1.0524193E-04 3 4.7376592E+06 -1.1371817E-02 5.4925731E-03 -2.7404986E-03 1.4863660E-03 8.1864963E-04 -4.2761224E-04 1.8399950E-04 4 1.7762539E+06 -1.8689549E-02 9.0391195E-03 -4.5113052E-03 2.4469820E-03 1.3477761E-03 -7.0400533E-04 3.0293125E-04 5 7.2910086E+05 -2.7555358E-02 1.3351781E-02 -6.6664711E-03 3.6163801E-03 1.9919066E-03 -1.0404638E-03 4.4770798E-04 6 3.1638078E+05 -3.9792398E-02 1.9319886E-02 -9.6511740E-03 5.2362173E-03 2.8843076E-03 -1.5066494E-03 6.4831105E-04 7 1.4475290E+05 -5.4063437E-02 2.6324535E-02 -1.3160885E-02 7.1420236E-03 3.9342288E-03 -2.0550805E-03 8.8429921E-04 8 6.8859125E+04 -7.1292042E-02 3.4846186E-02 -1.7442083E-02 9.4684586E-03 5.2165878E-03 -2.7251179E-03 1.1726367E-03 9 3.4016068E+04 -8.7969802E-02 4.3233294E-02 -2.1681315E-02 1.1776178E-02 6.4885452E-03 -3.3895595E-03 1.4585444E-03 10 1.7341712E+04 -1.0173951E-01 5.0301876E-02 -2.5288240E-02 1.3744758E-02 7.5759528E-03 -3.9582570E-03 1.7033317E-03 11 9.1259270E+03 -1.0423003E-01 5.1496793E-02 -2.5917611E-02 1.4091344E-02 7.7654455E-03 -4.0565852E-03 1.7455597E-03 12 4.9533506E+03 -9.0982524E-02 4.2871029E-02 -2.1264062E-02 1.1507992E-02 6.3375746E-03 -3.3109608E-03 1.4247775E-03 13 2.8007487E+03 -5.9037054E-02 1.9745976E-02 -8.1745516E-03 4.1429953E-03 2.2190864E-03 -1.1469312E-03 4.9218468E-04 14 1.7082851E+03 -2.6793648E-02 -5.8631081E-03 7.3134759E-03 -4.7666890E-03 -2.7290147E-03 1.4346106E-03 -6.1799349E-04 15 1.2173349E+03 -7.0823317E-03 -1.7699304E-02 1.4607669E-02 -9.0077915E-03 -5.2385609E-03 2.7963687E-03 -1.2100182E-03 16 8.6294330E+02 -5.7920602E-03 -3.6341112E-02 3.1414901E-02 -1.9780632E-02 -1.1306712E-02 5.9541126E-03 -2.5663877E-03 17 5.6496658E+02 1.4830339E-04 -4.8140104E-02 4.5652166E-02 -2.9661490E-02 -1.7373318E-02 9.2639100E-03 -4.0065626E-03 18 3.5814007E+02 -6.5180909E-04 -3.5679236E-02 3.7266129E-02 -2.5079529E-02 -1.4667623E-02 7.7802370E-03 -3.3594141E-03 19 2.2588018E+02 5.1421514E-04 -1.3809021E-02 3.3903492E-03 1.7086773E-04 3.2908016E-04 -1.7437738E-04 7.4092834E-05 20 1.4728989E+02 -4.6888858E-04 -2.0959608E-03 -2.7930154E-02 3.2019997E-02 2.2663933E-02 -1.2836612E-02 5.6335019E-03 21 9.8232993E+01 3.9480906E-04 -3.9515461E-04 -3.1906760E-02 4.3169535E-02 3.1264669E-02 -1.7631639E-02 7.7235404E-03 22 6.4461824E+01 -2.9422155E-04 1.2306649E-04 -1.7866187E-02 2.3663481E-02 1.7908601E-02 -1.0552296E-02 4.6828998E-03 23 4.1057454E+01 2.3294812E-04 -9.3659921E-05 -3.6795396E-03 -1.2165433E-02 -1.4635067E-02 9.4315444E-03 -4.2679509E-03 24 2.7263518E+01 -1.9379314E-04 8.0516419E-05 -2.5247746E-04 -2.4870625E-02 -3.6070369E-02 2.6235726E-02 -1.2242571E-02 25 1.8114011E+01 1.4224320E-04 -5.6709225E-05 -1.3089484E-06 -1.2247896E-02 -2.0497639E-02 1.4867567E-02 -6.8763891E-03 26 1.2146042E+01 -8.6210831E-05 3.4158296E-05 -1.2681070E-05 -2.6084629E-03 8.2124160E-03 -9.8704499E-03 4.9338139E-03 27 7.4510075E+00 4.5757439E-05 -1.8344117E-05 1.2025313E-05 -2.0683038E-04 1.7360352E-02 -2.2514078E-02 1.2239588E-02 28 4.4905823E+00 -3.2239301E-05 1.2809740E-05 -7.0155376E-06 1.5749607E-05 5.8910169E-03 -8.7148800E-03 5.3597945E-03 29 2.9534760E+00 2.3079763E-05 -9.1821292E-06 5.1148201E-06 -9.7340662E-06 3.7623589E-04 6.3629017E-03 -5.1056442E-03 30 1.8389254E+00 -1.2925349E-05 5.1582929E-06 -2.9205247E-06 4.8297242E-06 1.1974991E-04 6.7595971E-03 -6.5758007E-03 31 1.1616649E+00 6.3864444E-06 -2.5473597E-06 1.3724654E-06 -1.6606252E-06 -2.9327089E-05 2.8513391E-03 -3.4243477E-03 32 6.7542582E-01 -2.3764350E-06 9.4950998E-07 -5.0375827E-07 5.2437801E-07 6.5624987E-06 3.9893538E-04 1.3698189E-03 33 3.6699516E-01 7.9856864E-07 -3.1951476E-07 1.6677832E-07 -1.5733645E-07 -1.7035508E-06 8.0818880E-06 2.8803033E-03 34 1.8547942E-01 -2.2930122E-07 9.1742304E-08 -4.6159356E-08 3.2083391E-08 2.8849714E-07 3.3586645E-07 1.2172087E-03 35 8.1363389E-02 4.3885890E-08 -1.7584871E-08 8.7927855E-09 -5.5717689E-09 -2.9142370E-08 -3.4648183E-07 1.1315132E-04 2p- 3p- 4p- 5p- 6p- 7p- 1 8.9585293E+07 -4.5996662E-05 2.4283612E-05 -1.3223839E-05 7.1886420E-06 3.6365829E-06 1.4314773E-06 2 3.9223111E+07 -2.0652847E-04 1.0907840E-04 -5.9404485E-05 3.2291900E-05 1.6334416E-05 6.4295322E-06 3 1.6859972E+07 -4.6974038E-04 2.4822952E-04 -1.3520774E-04 7.3504800E-05 3.7184513E-05 1.4636975E-05 4 7.4062471E+06 -8.5739907E-04 4.5346831E-04 -2.4704955E-04 1.3430899E-04 6.7940523E-05 2.6742849E-05 5 3.3227938E+06 -1.4244558E-03 7.5419265E-04 -4.1100533E-04 2.2347417E-04 1.1305625E-04 4.4502943E-05 6 1.5196355E+06 -2.2487262E-03 1.1924737E-03 -6.5010206E-04 3.5349845E-04 1.7882683E-04 7.0390712E-05 7 7.0672255E+05 -3.4520791E-03 1.8342749E-03 -1.0005298E-03 5.4416612E-04 2.7532001E-04 1.0837802E-04 8 3.3373675E+05 -5.2105956E-03 2.7764116E-03 -1.5154827E-03 8.2434886E-04 4.1705737E-04 1.6416701E-04 9 1.5992130E+05 -7.7845443E-03 4.1626248E-03 -2.2742540E-03 1.2375230E-03 6.2621929E-04 2.4651623E-04 10 7.7759426E+04 -1.1550144E-02 6.2054765E-03 -3.3943581E-03 1.8474921E-03 9.3483970E-04 3.6799400E-04 11 3.8369207E+04 -1.7030803E-02 9.2039381E-03 -5.0421971E-03 2.7459102E-03 1.3898516E-03 5.4715786E-04 12 1.9222219E+04 -2.4833081E-02 1.3523953E-02 -7.4230276E-03 4.0442616E-03 2.0469590E-03 8.0581506E-04 13 9.7905772E+03 -3.5345444E-02 1.9433605E-02 -1.0693194E-02 5.8310454E-03 2.9526093E-03 1.1624952E-03 14 5.0805793E+03 -4.7907159E-02 2.6655886E-02 -1.4710688E-02 8.0273391E-03 4.0645992E-03 1.6002112E-03 15 2.6924053E+03 -5.9245427E-02 3.3304024E-02 -1.8423852E-02 1.0062863E-02 5.0982117E-03 2.0075297E-03 16 1.4602384E+03 -6.2604688E-02 3.4887920E-02 -1.9215064E-02 1.0475046E-02 5.3013682E-03 2.0868061E-03 17 8.1177386E+02 -5.1148800E-02 2.4791475E-02 -1.2821449E-02 6.8424776E-03 3.4446822E-03 1.3547515E-03 18 4.6208098E+02 -2.7467041E-02 -3.8089093E-04 4.1390803E-03 -3.0085069E-03 -1.6435608E-03 -6.5786438E-04 19 2.6846545E+02 -6.9673752E-03 -2.9698442E-02 2.5830597E-02 -1.5949379E-02 -8.3556735E-03 -3.3129130E-03 20 1.5944466E+02 6.5770447E-04 -4.0641285E-02 3.5928367E-02 -2.2627216E-02 -1.1961728E-02 -4.7546535E-03 21 9.6709997E+01 1.2403678E-03 -2.5745035E-02 1.8086829E-02 -9.7866391E-03 -4.8518710E-03 -1.8970715E-03 22 5.9030613E+01 9.0335701E-04 -7.6563779E-03 -1.2586724E-02 1.3738237E-02 8.1756644E-03 3.3247380E-03 23 3.6544258E+01 5.9694455E-04 -7.4139740E-04 -2.5670359E-02 2.6867290E-02 1.6701164E-02 6.8832781E-03 24 2.3046393E+01 4.1720851E-04 -4.3560955E-05 -1.5143922E-02 1.4044952E-02 7.9073512E-03 3.1566506E-03 25 1.4323938E+01 3.1299800E-04 4.7072477E-05 -3.5286826E-03 -1.0164094E-02 -1.0457523E-02 -4.6883874E-03 26 8.7318867E+00 2.1105641E-04 9.0024624E-06 -1.5104230E-04 -1.5681453E-02 -1.5262691E-02 -6.9576882E-03 27 5.3019785E+00 1.5827825E-04 1.8586532E-05 2.2221874E-06 -6.3085922E-03 -4.0321758E-03 -1.6441260E-03 28 3.1677771E+00 9.9334596E-05 5.8816334E-06 2.8811412E-05 -8.4460232E-04 6.9445369E-03 4.5458835E-03 29 1.8575080E+00 8.2634263E-05 7.7836942E-06 1.1307800E-05 -2.1555294E-05 6.6571796E-03 4.6792480E-03 30 1.0630346E+00 4.2938966E-05 3.1532774E-06 9.6957891E-06 -1.7561915E-06 2.0505002E-03 7.2533824E-04 31 5.8991389E-01 4.3840476E-05 3.7568435E-06 7.4813065E-06 1.8364258E-06 2.0936618E-04 -2.3466521E-03 32 3.1336096E-01 1.4689670E-05 1.1716064E-06 2.9398740E-06 -2.1415027E-07 1.2247502E-05 -2.3741301E-03 33 1.6045866E-01 2.4154420E-05 2.0069330E-06 4.4168017E-06 1.4353275E-07 -5.7935086E-07 -9.5811549E-04 34 7.9367651E-02 2.7317537E-09 -1.7229839E-09 1.7211436E-08 -2.9171399E-08 1.3966345E-07 -1.1970095E-04 35 3.7533757E-02 1.3506334E-05 1.1159720E-06 2.5049462E-06 1.5686104E-08 -5.0149783E-07 -9.5723253E-07 2p+ 3p+ 4p+ 5p+ 6p+ 7p+ 1 8.9585293E+07 -1.7273100E-07 1.0009527E-07 -5.7065046E-08 -3.1574121E-08 1.5100991E-08 4.9201785E-09 2 3.9223111E+07 -1.0666070E-06 6.1601335E-07 -3.4410101E-07 -1.8518997E-07 8.7055713E-08 2.8272756E-08 3 1.6859972E+07 -3.0776093E-06 1.7807720E-06 -1.0063405E-06 -5.5029506E-07 2.6129288E-07 8.5019313E-08 4 7.4062471E+06 -7.9174662E-06 4.5754819E-06 -2.5637650E-06 -1.3856697E-06 6.5314970E-07 2.1222932E-07 5 3.3227938E+06 -1.9492116E-05 1.1276977E-05 -6.3593837E-06 -3.4673544E-06 1.6433830E-06 5.3454047E-07 6 1.5196355E+06 -4.6889950E-05 2.7112577E-05 -1.5217972E-05 -8.2437923E-06 3.8913551E-06 1.2647672E-06 7 7.0672255E+05 -1.1052195E-04 6.3959122E-05 -3.6029248E-05 -1.9612717E-05 9.2861289E-06 3.0199049E-06 8 3.3373675E+05 -2.5569274E-04 1.4797754E-04 -8.3149899E-05 -4.5101872E-05 2.1306553E-05 6.9260854E-06 9 1.5992130E+05 -5.7925541E-04 3.3559616E-04 -1.8898998E-04 -1.0279729E-04 4.8646344E-05 1.5818520E-05 10 7.7759426E+04 -1.2822815E-03 7.4370271E-04 -4.1833449E-04 -2.2709735E-04 1.0733154E-04 3.4893056E-05 11 3.8369207E+04 -2.7611977E-03 1.6054159E-03 -9.0470965E-04 -4.9202737E-04 2.3279404E-04 7.5695725E-05 12 1.9222219E+04 -5.7407843E-03 3.3508317E-03 -1.8886793E-03 -1.0261701E-03 4.8516173E-04 1.5773450E-04 13 9.7905772E+03 -1.1373273E-02 6.6868856E-03 -3.7797977E-03 -2.0572140E-03 9.7347228E-04 3.1654437E-04 14 5.0805793E+03 -2.1055092E-02 1.2530730E-02 -7.1028847E-03 -3.8661174E-03 1.8288434E-03 5.9464885E-04 15 2.6924053E+03 -3.5267372E-02 2.1403569E-02 -1.2209899E-02 -6.6638642E-03 3.1557627E-03 1.0263086E-03 16 1.4602384E+03 -5.0961542E-02 3.1786557E-02 -1.8266934E-02 -9.9833989E-03 4.7277741E-03 1.5375527E-03 17 8.1177386E+02 -5.9409089E-02 3.8095456E-02 -2.2103390E-02 -1.2130154E-02 5.7540761E-03 1.8719162E-03 18 4.6208098E+02 -5.0499253E-02 3.0336476E-02 -1.7042666E-02 -9.2259180E-03 4.3543831E-03 1.4152073E-03 19 2.6846545E+02 -2.7250355E-02 4.0793931E-03 9.2597459E-04 1.0899787E-03 -5.9050489E-04 -1.9660518E-04 20 1.5944466E+02 -7.5928670E-03 -2.6562562E-02 2.5351615E-02 1.6047105E-02 -7.9249391E-03 -2.5976055E-03 21 9.6709997E+01 -8.5377583E-04 -3.5000741E-02 3.3563437E-02 2.1103607E-02 -1.0363957E-02 -3.3931970E-03 22 5.9030613E+01 -2.0923857E-05 -1.9699073E-02 1.3084009E-02 7.0803924E-03 -3.3776335E-03 -1.1004905E-03 23 3.6544258E+01 1.3482604E-06 -4.7849026E-03 -1.4781928E-02 -1.5437788E-02 8.7442082E-03 2.9409579E-03 24 2.3046393E+01 4.3355456E-06 -4.6060249E-04 -2.2199454E-02 -2.4808210E-02 1.4237812E-02 4.7960049E-03 25 1.4323938E+01 -1.5624503E-06 -6.5805911E-07 -1.0457227E-02 -6.7529192E-03 2.8125076E-03 8.8134509E-04 26 8.7318867E+00 4.5214981E-07 -6.6191856E-08 -1.7073892E-03 1.2002775E-02 -1.0277599E-02 -3.7132752E-03 27 5.3019785E+00 -4.0652498E-07 4.2302950E-06 -8.6379845E-05 1.1501070E-02 -1.0834927E-02 -4.0370249E-03 28 3.1677771E+00 1.1444648E-07 -1.2499275E-06 -1.4271631E-06 3.3937162E-03 -5.2874683E-04 3.3358763E-05 29 1.8575080E+00 -1.9815143E-08 4.4229485E-07 6.0364980E-07 3.0324675E-04 6.1192023E-03 3.0753255E-03 30 1.0630346E+00 9.9764313E-10 -2.2399553E-07 5.4843586E-07 1.1142370E-05 4.4322040E-03 2.4905908E-03 31 5.8991389E-01 8.6845203E-09 5.1618905E-08 -8.6610046E-08 -1.4236413E-06 1.1462286E-03 1.1003820E-04 32 3.1336096E-01 -6.5561636E-09 -1.1627315E-08 3.0087389E-08 3.5268634E-08 9.6769310E-05 -1.4226176E-03 33 1.6045866E-01 4.0326252E-09 -6.2091347E-10 -8.1992993E-09 -1.2042277E-07 4.7261343E-06 -1.4800436E-03 34 7.9367651E-02 -1.9371649E-09 2.0860669E-09 2.5600199E-10 2.2653210E-08 2.6499209E-08 -7.7872132E-04 35 3.7533757E-02 5.9037616E-10 -9.4575562E-10 5.0275000E-10 -3.8508846E-09 2.8289520E-08 -1.3771782E-04 3d- 4d- 5d- 6d- 1 1.7146515E+06 -2.9661948E-06 1.8228460E-06 -9.6950022E-07 4.0167775E-07 2 3.9002835E+05 -1.3623330E-05 8.3780875E-06 -4.4630714E-06 1.8517291E-06 3 1.1920657E+05 -4.9820903E-05 3.0684917E-05 -1.6331362E-05 6.7677974E-06 4 4.2898801E+04 -1.6214743E-04 1.0001476E-04 -5.3315216E-05 2.2121808E-05 5 1.7301116E+04 -4.8277264E-04 2.9846989E-04 -1.5904654E-04 6.5936521E-05 6 7.6240437E+03 -1.3244456E-03 8.2114136E-04 -4.3830126E-04 1.8190222E-04 7 3.6101516E+03 -3.3369319E-03 2.0783078E-03 -1.1098823E-03 4.6040395E-04 8 1.8111322E+03 -7.6003308E-03 4.7645575E-03 -2.5509725E-03 1.0594328E-03 9 9.5119131E+02 -1.5313909E-02 9.7029228E-03 -5.2071558E-03 2.1626572E-03 10 5.1908916E+02 -2.6371975E-02 1.6909657E-02 -9.1117164E-03 3.7901327E-03 11 2.9204020E+02 -3.6519200E-02 2.3347681E-02 -1.2557074E-02 5.2173123E-03 12 1.6811751E+02 -3.7808942E-02 2.2809686E-02 -1.2040542E-02 4.9834725E-03 13 9.8506390E+01 -2.5828074E-02 8.6175658E-03 -2.9331970E-03 1.0258009E-03 14 5.8153603E+01 -1.0125394E-02 -1.2797808E-02 1.0838733E-02 -4.9315693E-03 15 3.4346492E+01 -1.7120050E-03 -2.3800636E-02 1.8510043E-02 -8.3925016E-03 16 2.0516044E+01 -2.6992407E-05 -1.6073048E-02 8.9682726E-03 -3.4471055E-03 17 1.2203608E+01 3.3498904E-05 -4.7279926E-03 -8.2639996E-03 5.4811550E-03 18 7.1058128E+00 2.2265425E-05 -4.7184678E-04 -1.3326633E-02 8.1877757E-03 19 4.0994313E+00 9.4713955E-06 -6.6509252E-06 -6.7427271E-03 2.5777427E-03 20 2.3166074E+00 5.2723150E-06 3.2410386E-06 -1.2926488E-03 -4.0062105E-03 21 1.2738921E+00 2.2528944E-06 1.4011486E-06 -6.4171200E-05 -5.1784443E-03 22 6.7701115E-01 1.3124849E-06 8.5304054E-07 -2.7031787E-07 -2.7244182E-03 23 3.4032476E-01 4.5074416E-07 2.7211597E-07 1.1268905E-06 -6.4304791E-04 24 1.4828610E-01 3.4864682E-07 2.3102847E-07 2.1957076E-07 -3.6427060E-05 3d+ 4d+ 5d+ 6d+ 1 1.7146515E+06 -1.8792066E-07 1.1602327E-07 -6.0723700E-08 2.4241697E-08 2 3.9002835E+05 -1.6983288E-06 1.0535157E-06 -5.6299079E-07 2.2857887E-07 3 1.1920657E+05 -1.0461610E-05 6.4760882E-06 -3.4242398E-06 1.3783969E-06 4 4.2898801E+04 -5.0680160E-05 3.1431770E-05 -1.6721767E-05 6.7639790E-06 5 1.7301116E+04 -2.0413521E-04 1.2664764E-04 -6.7154985E-05 2.7087266E-05 6 7.6240437E+03 -7.0327746E-04 4.3750671E-04 -2.3269133E-04 9.4053536E-05 7 3.6101516E+03 -2.1055261E-03 1.3145609E-03 -6.9872464E-04 2.8210170E-04 8 1.8111322E+03 -5.4778578E-03 3.4434567E-03 -1.8362121E-03 7.4250134E-04 9 9.5119131E+02 -1.2219113E-02 7.7643145E-03 -4.1484566E-03 1.6771526E-03 10 5.1908916E+02 -2.2813918E-02 1.4716658E-02 -7.9053041E-03 3.2021429E-03 11 2.9204020E+02 -3.3988709E-02 2.2011865E-02 -1.1823129E-02 4.7855271E-03 12 1.6811751E+02 -3.8048744E-02 2.3848699E-02 -1.2701562E-02 5.1353961E-03 13 9.8506390E+01 -2.8366277E-02 1.2372640E-02 -5.3596780E-03 2.0292527E-03 14 5.8153603E+01 -1.2413348E-02 -8.6981394E-03 8.0449665E-03 -3.6011536E-03 15 3.4346492E+01 -2.5356206E-03 -2.2721260E-02 1.7792142E-02 -7.8571120E-03 16 2.0516044E+01 -1.5370127E-04 -1.7615520E-02 1.1319993E-02 -4.5649557E-03 17 1.2203608E+01 -8.6901116E-06 -5.8899640E-03 -5.7245950E-03 3.9156141E-03 18 7.1058128E+00 6.2851493E-06 -7.2300900E-04 -1.3100295E-02 7.8182037E-03 19 4.0994313E+00 -6.6798612E-07 -2.1596221E-05 -7.6677090E-03 3.6360419E-03 20 2.3166074E+00 7.3748320E-07 -2.8125537E-06 -1.7086240E-03 -2.9818496E-03 21 1.2738921E+00 -2.4240742E-07 8.2403122E-07 -1.1451119E-04 -5.0722435E-03 22 6.7701115E-01 8.8158918E-08 -2.1333489E-07 -3.6425018E-06 -3.0443270E-03 23 3.4032476E-01 -2.4498177E-08 4.0378254E-08 7.5374460E-07 -8.4709112E-04 24 1.4828610E-01 4.9948182E-09 -1.4641645E-08 1.0871363E-07 -7.4797810E-05 4f- 5f- 1 8.1055050E+03 -3.1538825E-05 1.6414991E-05 2 2.5752043E+03 -2.1044647E-04 1.1053392E-04 3 1.0597230E+03 -9.2669978E-04 4.8542727E-04 4 4.9773588E+02 -3.1003027E-03 1.6367578E-03 5 2.5431382E+02 -7.8530765E-03 4.1453456E-03 6 1.3671263E+02 -1.5331989E-02 8.1620497E-03 7 7.6260821E+01 -2.2462989E-02 1.1621526E-02 8 4.3298291E+01 -2.3512390E-02 1.1137177E-02 9 2.4936486E+01 -1.6316629E-02 4.2850390E-03 10 1.4373377E+01 -6.4934281E-03 -6.3822085E-03 11 8.1719534E+00 -1.1888938E-03 -1.1507886E-02 12 4.6189096E+00 -6.0830880E-05 -8.8156656E-03 13 2.5863476E+00 -1.0482193E-06 -3.7047087E-03 14 1.3957268E+00 1.5834753E-06 -7.9389234E-04 15 6.3932727E-01 1.2837195E-07 -4.6991178E-05 16 2.6314772E-01 6.8292305E-08 5.5173966E-07 4f+ 5f+ 1 8.1055050E+03 -1.8588307E-05 9.6036480E-06 2 2.5752043E+03 -1.5211263E-04 7.9483276E-05 3 1.0597230E+03 -7.5196342E-04 3.9167382E-04 4 4.9773588E+02 -2.6844509E-03 1.4095432E-03 5 2.5431382E+02 -7.1554853E-03 3.7582008E-03 6 1.3671263E+02 -1.4483584E-02 7.6750628E-03 7 7.6260821E+01 -2.1749932E-02 1.1260937E-02 8 4.3298291E+01 -2.3476862E-02 1.1211308E-02 9 2.4936486E+01 -1.6839394E-02 4.9241804E-03 10 1.4373377E+01 -6.9538949E-03 -5.5855802E-03 11 8.1719534E+00 -1.3525751E-03 -1.1227189E-02 12 4.6189096E+00 -7.9402159E-05 -8.9790730E-03 13 2.5863476E+00 -3.5078029E-06 -3.9492503E-03 14 1.3957268E+00 1.2575899E-06 -9.1150348E-04 15 6.3932727E-01 -9.5606973E-08 -5.9696031E-05 16 2.6314772E-01 3.2374396E-08 7.2032250E-07 Spin-free Dirac-Hartree-Fock basis sets ======================================= ** Uut 287 ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2719640E+07 1.6773790E-03 -7.8710715E-04 3.9187587E-04 2.1116597E-04 -1.1431105E-04 5.6963227E-05 2.1243964E-05 2 1.4018117E+07 3.6977254E-03 -1.7464872E-03 8.7057308E-04 4.6926438E-04 -2.5405160E-04 1.2660182E-04 4.7215405E-05 3 4.7691592E+06 6.6861341E-03 -3.1811343E-03 1.5878466E-03 8.5619926E-04 -4.6358211E-04 2.3102468E-04 8.6159739E-05 4 1.7943097E+06 1.0920779E-02 -5.2549338E-03 2.6283914E-03 1.4180410E-03 -7.6790496E-04 3.8270014E-04 1.4272820E-04 5 7.3981554E+05 1.7401008E-02 -8.4826409E-03 4.2527811E-03 2.2958253E-03 -1.2434879E-03 6.1975046E-04 2.3113793E-04 6 3.2295501E+05 2.6860992E-02 -1.3326492E-02 6.7021846E-03 3.6210236E-03 -1.9616921E-03 9.7776485E-04 3.6466816E-04 7 1.4881309E+05 4.1030647E-02 -2.0754311E-02 1.0473461E-02 5.6636269E-03 -3.0691821E-03 1.5298997E-03 5.7059602E-04 8 7.1367052E+04 6.1588547E-02 -3.1886395E-02 1.6156984E-02 8.7461085E-03 -4.7408493E-03 2.3633606E-03 8.8147861E-04 9 3.5520681E+04 9.0674297E-02 -4.8098235E-02 2.4477678E-02 1.3265756E-02 -7.1938278E-03 3.5866304E-03 1.3377171E-03 10 1.8216486E+04 1.2833634E-01 -6.9942181E-02 3.5771555E-02 1.9410529E-02 -1.0528479E-02 5.2495667E-03 1.9580944E-03 11 9.6229816E+03 1.6849605E-01 -9.4057021E-02 4.8313838E-02 2.6248624E-02 -1.4246365E-02 7.1045375E-03 2.6498077E-03 12 5.2295339E+03 1.9462021E-01 -1.0912505E-01 5.5922187E-02 3.0347786E-02 -1.6456574E-02 8.2047687E-03 3.0606913E-03 13 2.9214734E+03 1.8279645E-01 -8.9469415E-02 4.3061360E-02 2.2909974E-02 -1.2363981E-02 6.1552768E-03 2.2939491E-03 14 1.6736199E+03 1.2310241E-01 -2.4575766E-03 -1.4354626E-02 -1.0563523E-02 6.2432723E-03 -3.1878732E-03 -1.1921418E-03 15 9.8820875E+02 4.9439768E-02 1.6027892E-01 -1.3682987E-01 -8.4562934E-02 4.7603839E-02 -2.3993437E-02 -8.9759029E-03 16 5.9356725E+02 1.0093287E-02 3.2875040E-01 -3.0498773E-01 -1.9507654E-01 1.1141831E-01 -5.6391637E-02 -2.1085309E-02 17 3.6125652E+02 1.7626292E-04 3.5259484E-01 -3.7595367E-01 -2.4999320E-01 1.4381926E-01 -7.2947158E-02 -2.7335825E-02 18 2.2223702E+02 4.2172549E-04 1.9830198E-01 -1.6186995E-01 -1.0220092E-01 6.0087302E-02 -3.0746658E-02 -1.1468227E-02 19 1.3980540E+02 -4.3263282E-04 4.7855147E-02 3.1812882E-01 3.5348842E-01 -2.4105385E-01 1.2861174E-01 4.8531957E-02 20 8.8585590E+01 3.7672244E-04 5.8320897E-03 5.8183747E-01 7.7306835E-01 -5.5058368E-01 2.9671237E-01 1.1271981E-01 21 5.6149197E+01 -3.8662432E-04 -8.4068979E-04 3.7209106E-01 5.0307543E-01 -3.6359457E-01 1.9926686E-01 7.5390967E-02 22 3.5546788E+01 4.3162149E-04 9.8615271E-04 9.2773357E-02 -2.5611563E-01 2.8000756E-01 -1.6118569E-01 -6.0791979E-02 23 2.4318016E+01 -4.3708521E-04 -1.1427525E-03 5.7810559E-03 -7.0681420E-01 9.8477996E-01 -6.8107819E-01 -2.7462157E-01 24 1.6404019E+01 3.6200384E-04 8.4958984E-04 2.7968112E-03 -4.9988932E-01 8.2279934E-01 -5.5056052E-01 -2.1378585E-01 25 1.1201716E+01 -2.4409537E-04 -5.8078370E-04 -9.3532371E-04 -1.4946641E-01 -1.0773904E-01 1.5668541E-01 6.2261144E-02 26 7.2464938E+00 1.3428909E-04 3.3399796E-04 2.7368930E-04 -2.4375372E-02 -8.2884337E-01 9.3445063E-01 4.1830917E-01 27 4.6003323E+00 -7.1727950E-05 -1.6843098E-04 -2.6162936E-04 1.3635007E-03 -6.8573346E-01 9.0561707E-01 4.3186745E-01 28 2.5948426E+00 4.8645861E-05 1.1786419E-04 1.2336966E-04 -1.7877447E-03 -1.5635930E-01 -1.1544341E-01 -8.5065315E-02 29 1.7184194E+00 -4.1772197E-05 -1.0214674E-04 -1.0181004E-04 1.4407261E-03 2.3313357E-02 -7.4197083E-01 -5.3507231E-01 30 1.0873304E+00 2.8743694E-05 6.9624315E-05 7.7017208E-05 -9.2414141E-04 -1.5363749E-02 -5.0987961E-01 -4.0607414E-01 31 7.3659376E-01 -1.6313042E-05 -3.9897267E-05 -4.0691805E-05 5.5094466E-04 7.4237558E-03 -1.9810075E-01 -2.4186178E-01 32 4.7125807E-01 5.1464245E-06 1.2522460E-05 1.3679360E-05 -1.6643904E-04 -2.1734293E-03 -6.0405808E-02 1.8463567E-01 33 2.2988689E-01 -9.7054369E-07 -2.3750311E-06 -2.4621071E-06 3.3015657E-05 3.9266646E-04 -4.2161113E-03 6.2336479E-01 34 1.1152686E-01 2.6205722E-07 6.4292569E-07 6.6367254E-07 -8.9222450E-06 -1.0400099E-04 2.6743369E-07 4.9374117E-01 35 5.0196440E-02 -4.9003641E-08 -1.1918602E-07 -1.3297249E-07 1.6117256E-06 1.9632669E-05 3.7093236E-06 9.0611578E-02 2p 3p 4p 5p 6p 7p 1 8.7882223E+07 6.1814924E-06 -3.3983369E-06 1.8680880E-06 -9.9239076E-07 4.4553906E-07 -1.0356736E-07 2 3.7925146E+07 2.9359935E-05 -1.6132686E-05 8.8660533E-06 -4.7087326E-06 2.1136166E-06 -4.9130491E-07 3 1.6097922E+07 6.6775270E-05 -3.6702433E-05 2.0173972E-05 -1.0716423E-05 4.8109955E-06 -1.1183284E-06 4 7.0050657E+06 1.2826955E-04 -7.0532956E-05 3.8770206E-05 -2.0591742E-05 9.2431327E-06 -2.1485460E-06 5 3.1199170E+06 2.3096029E-04 -1.2709671E-04 6.9883290E-05 -3.7126352E-05 1.6668115E-05 -3.8745728E-06 6 1.4185524E+06 4.0593084E-04 -2.2362960E-04 1.2298184E-04 -6.5325419E-05 2.9323226E-05 -6.8161281E-06 7 6.5664636E+05 7.0809544E-04 -3.9076793E-04 2.1502834E-04 -1.1426757E-04 5.1306364E-05 -1.1926562E-05 8 3.0901950E+05 1.2415241E-03 -6.8690709E-04 3.7817071E-04 -2.0092900E-04 9.0195668E-05 -2.0965911E-05 9 1.4768105E+05 2.2118872E-03 -1.2285099E-03 6.7719559E-04 -3.6007826E-04 1.6170918E-04 -3.7591727E-05 10 7.1613099E+04 4.0486426E-03 -2.2610231E-03 1.2477908E-03 -6.6337954E-04 2.9781744E-04 -6.9228515E-05 11 3.5229671E+04 7.6701382E-03 -4.3159956E-03 2.3874783E-03 -1.2709045E-03 5.7096643E-04 -1.3273713E-04 12 1.7604081E+04 1.5037762E-02 -8.5456552E-03 4.7375137E-03 -2.5217196E-03 1.1323844E-03 -2.6323603E-04 13 8.9556177E+03 3.0157421E-02 -1.7358698E-02 9.6609434E-03 -5.1525060E-03 2.3161643E-03 -5.3850485E-04 14 4.6486654E+03 6.0251484E-02 -3.5266869E-02 1.9704929E-02 -1.0511359E-02 4.7224627E-03 -1.0978734E-03 15 2.4651972E+03 1.1476149E-01 -6.8660157E-02 3.8621323E-02 -2.0666472E-02 9.2993504E-03 -2.1624145E-03 16 1.3352849E+03 1.9573049E-01 -1.2018545E-01 6.8040388E-02 -3.6424713E-02 1.6376853E-02 -3.8077048E-03 17 7.3853195E+02 2.7332727E-01 -1.7034263E-01 9.6948557E-02 -5.2095869E-02 2.3478859E-02 -5.4609348E-03 18 4.1658693E+02 2.7405480E-01 -1.4619418E-01 7.6854054E-02 -3.9939475E-02 1.7770031E-02 -4.1249426E-03 19 2.3886203E+02 1.6580761E-01 4.3724892E-02 -6.1845804E-02 3.9478640E-02 -1.8456941E-02 4.3165985E-03 20 1.3924505E+02 4.6388743E-02 3.4399693E-01 -3.1665880E-01 1.9578014E-01 -9.1722424E-02 2.1458944E-02 21 8.2537435E+01 4.3447066E-03 4.4108279E-01 -4.0549564E-01 2.4500044E-01 -1.1319298E-01 2.6424254E-02 22 4.8960936E+01 -1.2381527E-05 2.3761502E-01 -3.2811081E-02 -2.2065441E-02 1.4569374E-02 -3.5576896E-03 23 2.9261456E+01 -2.9711965E-05 4.5243871E-02 5.0478907E-01 -5.0809154E-01 2.7357571E-01 -6.5377952E-02 24 1.7786803E+01 -8.1179065E-05 3.3448564E-03 5.1661592E-01 -5.4435809E-01 2.8575105E-01 -6.7924030E-02 25 1.0661314E+01 5.2347859E-05 -5.7883330E-04 1.7670728E-01 1.8467243E-01 -1.7398592E-01 4.4360514E-02 26 6.2850853E+00 -2.2920118E-05 1.9251487E-04 1.6418749E-02 6.7870353E-01 -5.5630422E-01 1.4197133E-01 27 3.6862451E+00 2.2137359E-05 -2.5125745E-04 1.5072113E-03 4.0506700E-01 -3.0971689E-01 7.8431535E-02 28 2.1219448E+00 -1.2565049E-05 1.3805936E-04 -4.8886536E-04 7.6137243E-02 3.3076354E-01 -1.0984773E-01 29 1.1993318E+00 6.6329597E-06 -7.3289995E-05 2.0000649E-04 4.3927983E-03 5.7522564E-01 -1.9704938E-01 30 6.6134078E-01 -3.8577802E-06 4.2660817E-05 -1.4205576E-04 1.9695477E-04 3.3595733E-01 -1.1975547E-01 31 3.5182344E-01 1.7103428E-06 -1.9235405E-05 6.1202810E-05 -7.2482068E-05 8.0943102E-02 5.4209725E-02 32 1.7204980E-01 -7.9319134E-07 8.8435809E-06 -2.7656696E-05 -3.5262769E-05 7.8341170E-03 2.6486390E-01 33 8.1358919E-02 3.7003540E-07 -4.1526606E-06 1.3375120E-05 2.6369517E-07 4.9009621E-04 4.2548456E-01 34 3.8116773E-02 -1.5776409E-07 1.7729772E-06 -5.6233140E-06 -3.2619648E-06 9.4588627E-05 3.5551421E-01 35 1.7566317E-02 4.3947090E-08 -4.9342660E-07 1.5891478E-06 3.5466484E-07 1.0587239E-05 8.0539162E-02 3d 4d 5d 6d 1 1.1671412E+06 2.6676714E-06 -1.6160569E-06 8.3245182E-07 -2.8986283E-07 2 2.6691682E+05 1.2950457E-05 -7.8476749E-06 4.0416230E-06 -1.4072985E-06 3 8.2116423E+04 5.2748909E-05 -3.2031512E-05 1.6511977E-05 -5.7503913E-06 4 2.9783340E+04 1.9867774E-04 -1.2082742E-04 6.2283206E-05 -2.1691509E-05 5 1.2124264E+04 7.2396554E-04 -4.4208090E-04 2.2824277E-04 -7.9513251E-05 6 5.3960761E+03 2.5590827E-03 -1.5679326E-03 8.0984104E-04 -2.8216767E-04 7 2.5813010E+03 8.5262384E-03 -5.2591694E-03 2.7227037E-03 -9.4907824E-04 8 1.3086162E+03 2.5711095E-02 -1.5974754E-02 8.2825525E-03 -2.8882222E-03 9 6.9434397E+02 6.7813395E-02 -4.2736288E-02 2.2257279E-02 -7.7685699E-03 10 3.8229501E+02 1.4943073E-01 -9.5223238E-02 4.9704561E-02 -1.7357649E-02 11 2.1624254E+02 2.5763966E-01 -1.6306708E-01 8.5064881E-02 -2.9702048E-02 12 1.2498461E+02 3.2002624E-01 -1.8413285E-01 9.2493114E-02 -3.2000082E-02 13 7.3145142E+01 2.4948155E-01 -3.9590330E-02 -3.0219297E-03 2.9905202E-03 14 4.3011978E+01 1.0499490E-01 2.4975747E-01 -1.9166799E-01 7.2108330E-02 15 2.5495125E+01 1.7869174E-02 4.4422940E-01 -3.2889924E-01 1.2333001E-01 16 1.5154401E+01 1.1588120E-03 3.1579730E-01 -1.1227290E-01 2.6994498E-02 17 8.9264900E+00 -1.9956681E-04 9.5451598E-02 3.3029617E-01 -1.6633269E-01 18 5.1621578E+00 -1.0669515E-05 9.5591196E-03 5.0477000E-01 -2.4943009E-01 19 2.9319801E+00 -6.5290995E-05 5.5616668E-04 2.8744745E-01 -6.2793538E-02 20 1.6103860E+00 1.6248924E-05 -4.4139548E-05 6.3535347E-02 2.5685269E-01 21 8.5312386E-01 -1.0735421E-05 2.1446342E-05 4.1289854E-03 4.1830009E-01 22 4.3318267E-01 4.7299766E-06 -1.4712825E-05 4.0705365E-04 3.4917811E-01 23 2.0988029E-01 -1.8561715E-06 5.5172068E-06 -6.5016137E-05 1.6707995E-01 24 9.3438434E-02 4.8229629E-07 -1.2868042E-06 1.2280268E-05 2.9399900E-02 4f 5f 1 6.6678464E+03 5.0700562E-05 -2.4618439E-05 2 2.1345513E+03 4.8492395E-04 -2.3744135E-04 3 8.8310589E+02 3.0626433E-03 -1.4959126E-03 4 4.1621459E+02 1.4367174E-02 -7.0744554E-03 5 2.1293537E+02 4.9596072E-02 -2.4405348E-02 6 1.1439928E+02 1.2915296E-01 -6.4130837E-02 7 6.3659645E+01 2.4602143E-01 -1.1834357E-01 8 3.5985904E+01 3.3335462E-01 -1.4621148E-01 9 2.0594089E+01 2.9505685E-01 -6.6878122E-02 10 1.1743615E+01 1.4821444E-01 1.5890779E-01 11 6.5450100E+00 3.3759433E-02 3.6879310E-01 12 3.5557317E+00 1.9392861E-03 3.8555780E-01 13 1.8463768E+00 1.1514319E-04 2.1989004E-01 14 8.8758782E-01 -7.6517286E-05 5.8090960E-02 15 3.7354701E-01 1.9566729E-05 3.9973913E-03 16 2.1624908E-01 -1.2045517E-05 3.0277397E-04 Pseudo-large component functions -------------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2719640E+07 3.4011393E-05 -1.5898151E-05 7.9094851E-06 4.2613018E-06 -2.3066596E-06 1.1494317E-06 4.2866912E-07 2 1.4018117E+07 2.1121532E-04 -9.8752167E-05 4.9132364E-05 2.6470692E-05 -1.4328614E-05 7.1400833E-06 2.6628314E-06 3 4.7691592E+06 6.3961318E-04 -2.9946845E-04 1.4903610E-04 8.0301350E-05 -4.3468699E-05 2.1661069E-05 8.0782830E-06 4 1.7943097E+06 1.7377764E-03 -8.1473619E-04 4.0557927E-04 2.1854212E-04 -1.1830144E-04 5.8951369E-05 2.1985500E-05 5 7.3981554E+05 4.0527004E-03 -1.9038399E-03 9.4814093E-04 5.1095966E-04 -2.7661056E-04 1.3784153E-04 5.1406662E-05 6 3.2295501E+05 8.9998605E-03 -4.2383502E-03 2.1119376E-03 1.1382897E-03 -6.1622081E-04 3.0707802E-04 1.1452365E-04 7 1.4881309E+05 1.8337906E-02 -8.6686196E-03 4.3234662E-03 2.3308991E-03 -1.2620213E-03 6.2892008E-04 2.3454989E-04 8 7.1367052E+04 3.5653111E-02 -1.6949253E-02 8.4655527E-03 4.5656452E-03 -2.4720552E-03 1.2319470E-03 4.5945994E-04 9 3.5520681E+04 6.4186754E-02 -3.0784449E-02 1.5412542E-02 8.3182557E-03 -4.5054003E-03 2.2454707E-03 8.3743203E-04 10 1.8216486E+04 1.0755780E-01 -5.2273603E-02 2.6268341E-02 1.4190588E-02 -7.6868450E-03 3.8312350E-03 1.4289528E-03 11 9.6229816E+03 1.5969190E-01 -7.8879035E-02 3.9833210E-02 2.1550825E-02 -1.1682533E-02 5.8239444E-03 2.1720011E-03 12 5.2295339E+03 2.0316941E-01 -1.0074530E-01 5.0950188E-02 2.7566649E-02 -1.4935356E-02 7.4444772E-03 2.7769488E-03 13 2.9214734E+03 2.0284213E-01 -8.9908931E-02 4.3592389E-02 2.3284623E-02 -1.2582728E-02 6.2666692E-03 2.3357221E-03 14 1.6736199E+03 1.4361750E-01 -1.0740148E-02 -7.3635777E-03 -6.2471006E-03 3.8094819E-03 -1.9606956E-03 -7.3341952E-04 15 9.8820875E+02 5.8142292E-02 1.5216567E-01 -1.2629566E-01 -7.7566644E-02 4.3581803E-02 -2.1954351E-02 -8.2125812E-03 16 5.9356725E+02 1.3333086E-02 3.2740488E-01 -2.9592459E-01 -1.8826489E-01 1.0736996E-01 -5.4319825E-02 -2.0308545E-02 17 3.6125652E+02 -1.1817231E-03 3.5981701E-01 -3.7493553E-01 -2.4847848E-01 1.4282452E-01 -7.2425590E-02 -2.7138981E-02 18 2.2223702E+02 2.2631610E-03 2.0333529E-01 -1.6645244E-01 -1.0639834E-01 6.2725659E-02 -3.2117364E-02 -1.1984348E-02 19 1.3980540E+02 -2.6843044E-03 5.0502013E-02 3.1376163E-01 3.4633034E-01 -2.3572989E-01 1.2570284E-01 4.7426725E-02 20 8.8585590E+01 3.0298829E-03 4.8922314E-03 5.8450850E-01 7.7131236E-01 -5.4861790E-01 2.9556678E-01 1.1227833E-01 21 5.6149197E+01 -3.5517968E-03 4.8894894E-04 3.7404737E-01 5.0475353E-01 -3.6503278E-01 2.0005154E-01 7.5689622E-02 22 3.5546788E+01 4.7260335E-03 -8.2884124E-04 9.4711152E-02 -2.5331396E-01 2.7656768E-01 -1.5896856E-01 -5.9920509E-02 23 2.4318016E+01 -5.6513800E-03 1.0715701E-03 4.5152724E-03 -7.0827585E-01 9.8417698E-01 -6.8023960E-01 -2.7425173E-01 24 1.6404019E+01 5.4776525E-03 -1.3351180E-03 4.1095829E-03 -5.0015153E-01 8.2312158E-01 -5.5091479E-01 -2.1394708E-01 25 1.1201716E+01 -4.3647282E-03 1.1872527E-03 -1.9829421E-03 -1.5053242E-01 -1.0660242E-01 1.5565403E-01 6.1833106E-02 26 7.2464938E+00 2.9343646E-03 -8.7265384E-04 9.8313675E-04 -2.4001013E-02 -8.2914290E-01 9.3410460E-01 4.1809145E-01 27 4.6003323E+00 -1.9248354E-03 6.3349655E-04 -7.3150334E-04 1.0785573E-03 -6.8601758E-01 9.0576453E-01 4.3193145E-01 28 2.5948426E+00 1.7246292E-03 -6.1043703E-04 5.4827530E-04 -1.5312271E-03 -1.5660407E-01 -1.1521029E-01 -8.4906864E-02 29 1.7184194E+00 -1.8204819E-03 6.7267959E-04 -5.5285290E-04 1.1677280E-03 2.3468128E-02 -7.4210817E-01 -5.3508455E-01 30 1.0873304E+00 1.5841450E-03 -6.0947565E-04 4.7162879E-04 -6.8468119E-04 -1.5495178E-02 -5.0986558E-01 -4.0604770E-01 31 7.3659376E-01 -1.1080845E-03 4.3754129E-04 -3.1775516E-04 3.8253846E-04 7.5136133E-03 -1.9817704E-01 -2.4189391E-01 32 4.7125807E-01 4.4737430E-04 -1.8116091E-04 1.2594593E-04 -9.8065323E-05 -2.2092091E-03 -6.0393733E-02 1.8463477E-01 33 2.2988689E-01 -1.2815762E-04 5.3432740E-05 -3.4764111E-05 1.3294149E-05 4.0278371E-04 -4.2220522E-03 6.2336390E-01 34 1.1152686E-01 5.4237684E-05 -2.3071114E-05 1.4376407E-05 -5.3433815E-07 -1.0824754E-04 2.6082879E-06 4.9374728E-01 35 5.0196440E-02 -1.7393175E-05 7.5082599E-06 -4.5404166E-06 -1.0884144E-06 2.0986463E-05 2.9613194E-06 9.0612241E-02 2p 3p 4p 5p 6p 7p 1 8.7882223E+07 4.0388432E-08 -2.2220820E-08 1.2229258E-08 -6.5090643E-09 2.9266945E-09 -6.8047799E-10 2 3.7925146E+07 2.8926476E-07 -1.5921168E-07 8.7482067E-08 -4.6412323E-08 2.0813994E-08 -4.8374834E-09 3 1.6097922E+07 1.0691975E-06 -5.8899461E-07 3.2411315E-07 -1.7237652E-07 7.7454016E-08 -1.8006785E-08 4 7.0050657E+06 3.2359658E-06 -1.7844153E-06 9.8105663E-07 -5.2065487E-07 2.3353544E-07 -5.4278661E-08 5 3.1199170E+06 9.0462908E-06 -4.9968411E-06 2.7515463E-06 -1.4636229E-06 6.5766413E-07 -1.5289658E-07 6 1.4185524E+06 2.4380023E-05 -1.3492649E-05 7.4251974E-06 -3.9417692E-06 1.7682042E-06 -4.1097422E-07 7 6.5664636E+05 6.4682982E-05 -3.5893689E-05 1.9788405E-05 -1.0529295E-05 4.7315372E-06 -1.1000188E-06 8 3.0901950E+05 1.7061784E-04 -9.4960474E-05 5.2336389E-05 -2.7797181E-05 1.2471379E-05 -2.8987292E-06 9 1.4768105E+05 4.4972341E-04 -2.5123682E-04 1.3874128E-04 -7.3853418E-05 3.3189263E-05 -7.7161224E-06 10 7.1613099E+04 1.1853144E-03 -6.6490593E-04 3.6722400E-04 -1.9518142E-04 8.7591843E-05 -2.0359813E-05 11 3.5229671E+04 3.1069163E-03 -1.7518839E-03 9.6973003E-04 -5.1649622E-04 2.3212994E-04 -5.3968242E-05 12 1.7604081E+04 7.9987060E-03 -4.5395629E-03 2.5150486E-03 -1.3381128E-03 6.0070451E-04 -1.3963450E-04 13 8.9556177E+03 1.9857217E-02 -1.1376442E-02 6.3239937E-03 -3.3722747E-03 1.5160327E-03 -3.5247974E-04 14 4.6486654E+03 4.6374881E-02 -2.6943174E-02 1.5022901E-02 -8.0078676E-03 3.5966985E-03 -8.3612097E-04 15 2.4651972E+03 9.8328518E-02 -5.8319836E-02 3.2733816E-02 -1.7506779E-02 7.8769327E-03 -1.8316319E-03 16 1.3352849E+03 1.7975503E-01 -1.0945644E-01 6.1837074E-02 -3.3081849E-02 1.4870606E-02 -3.4573787E-03 17 7.3853195E+02 2.6193499E-01 -1.6234611E-01 9.2320317E-02 -4.9602249E-02 2.2355069E-02 -5.1995580E-03 18 4.1658693E+02 2.6838215E-01 -1.4374020E-01 7.5937490E-02 -3.9540082E-02 1.7602239E-02 -4.0863479E-03 19 2.3886203E+02 1.6202841E-01 4.1636927E-02 -5.9055252E-02 3.7674610E-02 -1.7606210E-02 4.1173724E-03 20 1.3924505E+02 4.1735264E-02 3.4216578E-01 -3.1323880E-01 1.9342849E-01 -9.0595664E-02 2.1194489E-02 21 8.2537435E+01 -5.9083802E-04 4.4225174E-01 -4.0532480E-01 2.4485715E-01 -1.1312769E-01 2.6409069E-02 22 4.8960936E+01 -4.4355374E-03 2.3886736E-01 -3.4822217E-02 -2.0318417E-02 1.3678793E-02 -3.3466122E-03 23 2.9261456E+01 -3.8215988E-03 4.5629976E-02 5.0344627E-01 -5.0632624E-01 2.7257091E-01 -6.5136028E-02 24 1.7786803E+01 -3.3591464E-03 3.3227477E-03 5.1667537E-01 -5.4434828E-01 2.8579376E-01 -6.7936410E-02 25 1.0661314E+01 -3.0284493E-03 -5.2412210E-04 1.7637295E-01 1.8434890E-01 -1.7360919E-01 4.4262180E-02 26 6.2850853E+00 -2.6887231E-03 1.6620634E-04 1.5976509E-02 6.7879346E-01 -5.5616318E-01 1.4192862E-01 27 3.6862451E+00 -2.4472432E-03 -2.1232357E-04 9.9010858E-04 4.0531617E-01 -3.0986856E-01 7.8472205E-02 28 2.1219448E+00 -2.1293330E-03 1.2314793E-04 -8.7517304E-04 7.6200464E-02 3.3065618E-01 -1.0980937E-01 29 1.1993318E+00 -2.0525210E-03 -4.8012821E-05 -2.2278536E-04 4.4550122E-03 5.7516795E-01 -1.9702762E-01 30 6.6134078E-01 -1.6400689E-03 3.6640022E-05 -4.4741220E-04 2.2312245E-04 3.3592768E-01 -1.1974801E-01 31 3.5182344E-01 -1.8342236E-03 -4.0877984E-06 -3.0695505E-04 -2.4979508E-05 8.0883182E-02 5.4218908E-02 32 1.7204980E-01 -1.2942088E-03 8.5758846E-06 -2.7432092E-04 -1.0795850E-05 7.7930601E-03 2.6486960E-01 33 8.1358919E-02 -1.7385773E-03 6.1898192E-06 -3.3065858E-04 4.1922808E-05 4.3021443E-04 4.2549484E-01 34 3.8116773E-02 -3.0666504E-04 5.5097467E-07 -6.2741066E-05 1.6053964E-06 8.5231548E-05 3.5551639E-01 35 1.7566317E-02 -2.0547913E-03 8.4730807E-06 -4.0117009E-04 4.6922064E-05 -5.8900251E-05 8.0551415E-02 3d 4d 5d 6d 1 1.1671412E+06 1.1317430E-07 -6.8802781E-08 3.5515512E-08 -1.2370211E-08 2 2.6691682E+05 1.3337091E-06 -8.0859026E-07 4.1612449E-07 -1.4489013E-07 3 8.2116423E+04 1.0754592E-05 -6.5500142E-06 3.3810240E-06 -1.1777068E-06 4 2.9783340E+04 6.9493278E-05 -4.2291477E-05 2.1796836E-05 -7.5913658E-06 5 1.2124264E+04 3.7521988E-04 -2.2920743E-04 1.1836871E-04 -4.1237389E-05 6 5.3960761E+03 1.7255847E-03 -1.0559426E-03 5.4516519E-04 -1.8993395E-04 7 2.5813010E+03 6.7777287E-03 -4.1730840E-03 2.1594531E-03 -7.5265953E-04 8 1.3086162E+03 2.2559633E-02 -1.3984885E-02 7.2463164E-03 -2.5265483E-03 9 6.9434397E+02 6.3055367E-02 -3.9647410E-02 2.0636192E-02 -7.2017902E-03 10 3.8229501E+02 1.4373625E-01 -9.1428645E-02 4.7702284E-02 -1.6656888E-02 11 2.1624254E+02 2.5261305E-01 -1.5971634E-01 8.3297001E-02 -2.9083215E-02 12 1.2498461E+02 3.1722053E-01 -1.8265606E-01 9.1814511E-02 -3.1771527E-02 13 7.3145142E+01 2.4845552E-01 -4.0214538E-02 -2.3842218E-03 2.7419981E-03 14 4.3011978E+01 1.0436030E-01 2.4850321E-01 -1.9058443E-01 7.1690997E-02 15 2.5495125E+01 1.7257151E-02 4.4365850E-01 -3.2834921E-01 1.2312172E-01 16 1.5154401E+01 6.6836980E-04 3.1578648E-01 -1.1256641E-01 2.7152647E-02 17 8.9264900E+00 -5.3188311E-04 9.5348552E-02 3.2995841E-01 -1.6614113E-01 18 5.1621578E+00 -2.4713411E-04 9.4380141E-03 5.0464452E-01 -2.4934988E-01 19 2.9319801E+00 -2.1907081E-04 4.5031582E-04 2.8743005E-01 -6.2826247E-02 20 1.6103860E+00 -9.4833552E-05 -1.0694615E-04 6.3483632E-02 2.5681762E-01 21 8.5312386E-01 -7.7629778E-05 -2.5117742E-05 4.0954637E-03 4.1828027E-01 22 4.3318267E-01 -4.5134675E-05 -4.3024004E-05 3.7668390E-04 3.4917181E-01 23 2.0988029E-01 -2.4432282E-05 -1.0355296E-05 -7.6546772E-05 1.6707666E-01 24 9.3438434E-02 -2.5795099E-05 -1.7038231E-05 -3.1332288E-06 2.9395635E-02 4f 5f 1 6.6678464E+03 2.9125100E-05 -1.4106761E-05 2 2.1345513E+03 3.7974496E-04 -1.8600544E-04 3 8.8310589E+02 2.7184240E-03 -1.3268127E-03 4 4.1621459E+02 1.3530174E-02 -6.6599297E-03 5 2.1293537E+02 4.8098653E-02 -2.3657721E-02 6 1.1439928E+02 1.2716520E-01 -6.3126152E-02 7 6.3659645E+01 2.4415105E-01 -1.1743594E-01 8 3.5985904E+01 3.3214469E-01 -1.4570994E-01 9 2.0594089E+01 2.9460398E-01 -6.6925076E-02 10 1.1743615E+01 1.4806011E-01 1.5859648E-01 11 6.5450100E+00 3.3673245E-02 3.6854896E-01 12 3.5557317E+00 1.8803011E-03 3.8545654E-01 13 1.8463768E+00 8.8933081E-05 2.1985706E-01 14 8.8758782E-01 -9.0730295E-05 5.8074798E-02 15 3.7354701E-01 1.6145178E-05 3.9909434E-03 16 2.1624908E-01 -1.4674614E-05 2.9952774E-04 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2719640E+07 4.0210749E-03 -1.9022601E-03 9.4644345E-04 5.0993222E-04 -2.7599964E-04 1.3753877E-04 5.1292078E-05 2 1.4018117E+07 8.2029691E-03 -3.8933746E-03 1.9383942E-03 1.0445736E-03 -5.6540277E-04 2.8176240E-04 1.0507797E-04 3 4.7691592E+06 1.3571904E-02 -6.4676821E-03 3.2226613E-03 1.7370484E-03 -9.4028654E-04 4.6858674E-04 1.7475002E-04 4 1.7943097E+06 2.0573515E-02 -9.8754351E-03 4.9271211E-03 2.6567078E-03 -1.4382597E-03 7.1678090E-04 2.6731398E-04 5 7.3981554E+05 3.0257530E-02 -1.4660597E-02 7.3275562E-03 3.9529730E-03 -2.1403278E-03 1.0666833E-03 3.9779997E-04 6 3.2295501E+05 4.3206074E-02 -2.1235510E-02 1.0641844E-02 5.7447400E-03 -3.1111721E-03 1.5507020E-03 5.7833818E-04 7 1.4881309E+05 6.0950314E-02 -3.0493503E-02 1.5334008E-02 8.2852408E-03 -4.4882779E-03 2.2371147E-03 8.3430867E-04 8 7.1367052E+04 8.4631611E-02 -4.3351300E-02 2.1898616E-02 1.1844371E-02 -6.4180930E-03 3.1994100E-03 1.1932986E-03 9 3.5520681E+04 1.1576703E-01 -6.0914801E-02 3.0940010E-02 1.6760049E-02 -9.0870386E-03 4.5302279E-03 1.6895439E-03 10 1.8216486E+04 1.5341857E-01 -8.3298180E-02 4.2584183E-02 2.3103722E-02 -1.2531273E-02 6.2483914E-03 2.3307003E-03 11 9.6229816E+03 1.9040315E-01 -1.0644192E-01 5.4749670E-02 2.9752297E-02 -1.6149186E-02 8.0531129E-03 3.0034299E-03 12 5.2295339E+03 2.0968819E-01 -1.1836169E-01 6.0860417E-02 3.3051895E-02 -1.7929931E-02 8.9417698E-03 3.3361308E-03 13 2.9214734E+03 1.8874690E-01 -9.3011541E-02 4.5018579E-02 2.3981054E-02 -1.2947381E-02 6.4445782E-03 2.4014437E-03 14 1.6736199E+03 1.2155018E-01 9.0829644E-04 -1.6525055E-02 -1.1843726E-02 6.9569106E-03 -3.5443576E-03 -1.3243158E-03 15 9.8820875E+02 4.5691688E-02 1.6865765E-01 -1.4300716E-01 -8.8320756E-02 4.9711409E-02 -2.5059428E-02 -9.3760288E-03 16 5.9356725E+02 8.0591108E-03 3.3650617E-01 -3.1268798E-01 -2.0017674E-01 1.1436188E-01 -5.7883849E-02 -2.1642488E-02 17 3.6125652E+02 -5.5928200E-04 3.5469201E-01 -3.7992303E-01 -2.5308331E-01 1.4567216E-01 -7.3906525E-02 -2.7698820E-02 18 2.2223702E+02 2.2202402E-04 1.9642538E-01 -1.5976094E-01 -1.0113491E-01 5.9597709E-02 -3.0505650E-02 -1.1374842E-02 19 1.3980540E+02 -5.6049089E-04 4.6316533E-02 3.2347781E-01 3.5862435E-01 -2.4451355E-01 1.3044452E-01 4.9219837E-02 20 8.8585590E+01 3.5709232E-04 5.4456756E-03 5.8399257E-01 7.7682467E-01 -5.5340647E-01 2.9825877E-01 1.1331281E-01 21 5.6149197E+01 -4.2760917E-04 -9.8181836E-04 3.7140334E-01 5.0218097E-01 -3.6309774E-01 1.9904263E-01 7.5305319E-02 22 3.5546788E+01 4.4063065E-04 9.6789716E-04 9.2053758E-02 -2.5822215E-01 2.8169265E-01 -1.6208154E-01 -6.1124372E-02 23 2.4318016E+01 -4.5879249E-04 -1.1884831E-03 5.5754999E-03 -7.0809959E-01 9.8693785E-01 -6.8271700E-01 -2.7529521E-01 24 1.6404019E+01 3.7077702E-04 8.5244530E-04 2.7648346E-03 -4.9952023E-01 8.2253464E-01 -5.5034207E-01 -2.1368448E-01 25 1.1201716E+01 -2.5271581E-04 -5.9800388E-04 -9.3200360E-04 -1.4920404E-01 -1.0859272E-01 1.5731175E-01 6.2500491E-02 26 7.2464938E+00 1.3659705E-04 3.3446986E-04 2.6523634E-04 -2.4287433E-02 -8.2931796E-01 9.3501189E-01 4.1856996E-01 27 4.6003323E+00 -7.3919858E-05 -1.7067139E-04 -2.6542895E-04 1.3810721E-03 -6.8567459E-01 9.0559124E-01 4.3186941E-01 28 2.5948426E+00 4.9271103E-05 1.1943378E-04 1.2175222E-04 -1.7780649E-03 -1.5627881E-01 -1.1563391E-01 -8.5162886E-02 29 1.7184194E+00 -4.2739307E-05 -1.0342187E-04 -1.0287508E-04 1.4391727E-03 2.3357114E-02 -7.4208489E-01 -5.3515122E-01 30 1.0873304E+00 2.9218557E-05 7.0068407E-05 7.5533443E-05 -9.2194497E-04 -1.5379246E-02 -5.0983921E-01 -4.0605518E-01 31 7.3659376E-01 -1.6581920E-05 -4.0446413E-05 -4.0972880E-05 5.5320259E-04 7.4233993E-03 -1.9808836E-01 -2.4185910E-01 32 4.7125807E-01 5.2492798E-06 1.2466975E-05 1.3684291E-05 -1.6595197E-04 -2.1715213E-03 -6.0402097E-02 1.8465157E-01 33 2.2988689E-01 -9.8037562E-07 -2.5137448E-06 -2.9757126E-06 3.1523362E-05 3.9399898E-04 -4.2159862E-03 6.2336977E-01 34 1.1152686E-01 2.6645650E-07 6.1048869E-07 7.4102597E-07 -8.4284594E-06 -1.0469422E-04 1.7803685E-06 4.9374060E-01 35 5.0196440E-02 -5.0649999E-08 -1.6843228E-07 -9.0556895E-08 1.5501519E-06 1.9896712E-05 3.5489500E-06 9.0610685E-02 2p 3p 4p 5p 6p 7p 1 8.7882223E+07 2.6445140E-06 -1.4495380E-06 8.0240072E-07 -4.2882056E-07 1.9352797E-07 -4.5023432E-08 2 3.7925146E+07 2.5356908E-05 -1.3877749E-05 7.6219461E-06 -4.0409958E-06 1.8109414E-06 -4.2083486E-07 3 1.6097922E+07 6.1261141E-05 -3.3590329E-05 1.8489142E-05 -9.8373412E-06 4.4230166E-06 -1.0283897E-06 4 7.0050657E+06 1.2275016E-04 -6.7321413E-05 3.6992235E-05 -1.9619969E-05 8.7949716E-06 -2.0439096E-06 5 3.1199170E+06 2.3048014E-04 -1.2674797E-04 6.9806391E-05 -3.7143641E-05 1.6699043E-05 -3.8826220E-06 6 1.4185524E+06 4.2252886E-04 -2.3265394E-04 1.2796511E-04 -6.7897984E-05 3.0442472E-05 -7.0749175E-06 7 6.5664636E+05 7.6710350E-04 -4.2387572E-04 2.3368052E-04 -1.2436085E-04 5.5906211E-05 -1.2998354E-05 8 3.0901950E+05 1.3920098E-03 -7.7121872E-04 4.2483242E-04 -2.2555393E-04 1.0115780E-04 -2.3510487E-05 9 1.4768105E+05 2.5425663E-03 -1.4156863E-03 7.8174651E-04 -4.1616729E-04 1.8707595E-04 -4.3495211E-05 10 7.1613099E+04 4.7079468E-03 -2.6346919E-03 1.4549926E-03 -7.7320832E-04 3.4690910E-04 -8.0631591E-05 11 3.5229671E+04 8.8860910E-03 -5.0115399E-03 2.7757743E-03 -1.4787789E-03 6.6476796E-04 -1.5455920E-04 12 1.7604081E+04 1.7124462E-02 -9.7468566E-03 5.4061875E-03 -2.8770842E-03 1.2915059E-03 -3.0020826E-04 13 8.9556177E+03 3.3495777E-02 -1.9309791E-02 1.0755347E-02 -5.7388056E-03 2.5806254E-03 -6.0002600E-04 14 4.6486654E+03 6.5192466E-02 -3.8213328E-02 2.1361488E-02 -1.1394692E-02 5.1184800E-03 -1.1899061E-03 15 2.4651972E+03 1.2130552E-01 -7.2708874E-02 4.0929468E-02 -2.1908693E-02 9.8602282E-03 -2.2929034E-03 16 1.3352849E+03 2.0292937E-01 -1.2490268E-01 7.0770206E-02 -3.7892231E-02 1.7035940E-02 -3.9609180E-03 17 7.3853195E+02 2.7895122E-01 -1.7438544E-01 9.9374264E-02 -5.3424718E-02 2.4082890E-02 -5.6016126E-03 18 4.1658693E+02 2.7603354E-01 -1.4743753E-01 7.7556858E-02 -4.0307121E-02 1.7931409E-02 -4.1623296E-03 19 2.3886203E+02 1.6509358E-01 4.5870873E-02 -6.3483631E-02 4.0425960E-02 -1.8888169E-02 4.4170560E-03 20 1.3924505E+02 4.5572535E-02 3.4710230E-01 -3.1952941E-01 1.9759401E-01 -9.2580583E-02 2.1660023E-02 21 8.2537435E+01 4.1454159E-03 4.4205171E-01 -4.0663874E-01 2.4573022E-01 -1.1353117E-01 2.6503257E-02 22 4.8960936E+01 -4.7833592E-05 2.3718084E-01 -3.1753449E-02 -2.2811958E-02 1.4918875E-02 -3.6394223E-03 23 2.9261456E+01 -3.4615904E-05 4.4954407E-02 5.0598996E-01 -5.0931704E-01 2.7425627E-01 -6.5541378E-02 24 1.7786803E+01 -8.6400508E-05 3.3051637E-03 5.1668928E-01 -5.4453360E-01 2.8584292E-01 -6.7945762E-02 25 1.0661314E+01 5.2706856E-05 -5.8985342E-04 1.7652662E-01 1.8521105E-01 -1.7433229E-01 4.4445203E-02 26 6.2850853E+00 -2.4228212E-05 1.9387162E-04 1.6367299E-02 6.7891687E-01 -5.5650074E-01 1.4202310E-01 27 3.6862451E+00 2.2575208E-05 -2.5381653E-04 1.5041626E-03 4.0501830E-01 -3.0967272E-01 7.8420471E-02 28 2.1219448E+00 -1.2862028E-05 1.3862715E-04 -4.9188984E-04 7.6106459E-02 3.3084966E-01 -1.0987378E-01 29 1.1993318E+00 6.7734808E-06 -7.3909943E-05 2.0089464E-04 4.3884893E-03 5.7524550E-01 -1.9705725E-01 30 6.6134078E-01 -3.9536091E-06 4.2881558E-05 -1.4276597E-04 1.9648070E-04 3.3595101E-01 -1.1975401E-01 31 3.5182344E-01 1.7423995E-06 -1.9343155E-05 6.1416825E-05 -7.2657552E-05 8.0939455E-02 5.4212682E-02 32 1.7204980E-01 -8.1173395E-07 8.8850076E-06 -2.7774912E-05 -3.5271075E-05 7.8336977E-03 2.6486588E-01 33 8.1358919E-02 3.7825922E-07 -4.1762249E-06 1.3425063E-05 2.4226781E-07 4.8997092E-04 4.2548552E-01 34 3.8116773E-02 -1.6145774E-07 1.7822285E-06 -5.6471252E-06 -3.2535155E-06 9.4584397E-05 3.5551415E-01 35 1.7566317E-02 4.4864695E-08 -4.9620331E-07 1.5958054E-06 3.4787641E-07 1.0586482E-05 8.0539017E-02 3d 4d 5d 6d 1 1.1671412E+06 2.8431530E-06 -1.7160211E-06 8.8197635E-07 -3.0671534E-07 2 2.6691682E+05 1.4315252E-05 -8.6739339E-06 4.4720608E-06 -1.5585216E-06 3 8.2116423E+04 5.9920493E-05 -3.6323364E-05 1.8702518E-05 -6.5087035E-06 4 2.9783340E+04 2.2665276E-04 -1.3787980E-04 7.1120900E-05 -2.4780565E-05 5 1.2124264E+04 8.0974540E-04 -4.9413605E-04 2.5499243E-04 -8.8805290E-05 6 5.3960761E+03 2.7849189E-03 -1.7063967E-03 8.8157683E-04 -3.0721397E-04 7 2.5813010E+03 9.0485330E-03 -5.5805756E-03 2.8887557E-03 -1.0068721E-03 8 1.3086162E+03 2.6769357E-02 -1.6634864E-02 8.6258079E-03 -3.0081086E-03 9 6.9434397E+02 6.9634013E-02 -4.3899443E-02 2.2865178E-02 -7.9807465E-03 10 3.8229501E+02 1.5194709E-01 -9.6876802E-02 5.0575956E-02 -1.7662796E-02 11 2.1624254E+02 2.6012694E-01 -1.6473630E-01 8.5954381E-02 -3.0013945E-02 12 1.2498461E+02 3.2150218E-01 -1.8505382E-01 9.2967492E-02 -3.2165185E-02 13 7.3145142E+01 2.4969633E-01 -3.9210051E-02 -3.3284190E-03 3.1063032E-03 14 4.3011978E+01 1.0481435E-01 2.5066482E-01 -1.9231163E-01 7.2349054E-02 15 2.5495125E+01 1.7780074E-02 4.4478432E-01 -3.2936174E-01 1.2350868E-01 16 1.5154401E+01 1.1513173E-03 3.1578729E-01 -1.1212560E-01 2.6921213E-02 17 8.9264900E+00 -2.0289598E-04 9.5387246E-02 3.3056841E-01 -1.6645929E-01 18 5.1621578E+00 -9.8203052E-06 9.5402480E-03 5.0487069E-01 -2.4948670E-01 19 2.9319801E+00 -6.5924436E-05 5.5651754E-04 2.8743139E-01 -6.2769021E-02 20 1.6103860E+00 1.6510681E-05 -4.5316628E-05 6.3525167E-02 2.5688428E-01 21 8.5312386E-01 -1.0875832E-05 2.1895703E-05 4.1269481E-03 4.1831335E-01 22 4.3318267E-01 4.7882159E-06 -1.4937282E-05 4.0720816E-04 3.4917996E-01 23 2.0988029E-01 -1.8781512E-06 5.5956026E-06 -6.5134356E-05 1.6707937E-01 24 9.3438434E-02 4.8790654E-07 -1.3078264E-06 1.2304294E-05 2.9399623E-02 4f 5f 1 6.6678464E+03 5.6006378E-05 -2.7150551E-05 2 2.1345513E+03 5.1271015E-04 -2.5113249E-04 3 8.8310589E+02 3.1629193E-03 -1.5446167E-03 4 4.1621459E+02 1.4650396E-02 -7.2144795E-03 5 2.1293537E+02 5.0175680E-02 -2.4691462E-02 6 1.1439928E+02 1.3002485E-01 -6.4572673E-02 7 6.3659645E+01 2.4692531E-01 -1.1878321E-01 8 3.5985904E+01 3.3395722E-01 -1.4648248E-01 9 2.0594089E+01 2.9525064E-01 -6.6870132E-02 10 1.1743615E+01 1.4820616E-01 1.5909385E-01 11 6.5450100E+00 3.3742293E-02 3.6893470E-01 12 3.5557317E+00 1.9366226E-03 3.8560687E-01 13 1.8463768E+00 1.1512228E-04 2.1989229E-01 14 8.8758782E-01 -7.6558875E-05 5.8088966E-02 15 3.7354701E-01 1.9580997E-05 3.9970935E-03 16 2.1624908E-01 -1.2052355E-05 3.0272009E-04 ** Uuq 289 ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2603380E+07 1.7836112E-03 -8.4227442E-04 4.1957660E-04 2.2637135E-04 -1.2294760E-04 6.1842182E-05 2.4010400E-05 2 1.3986165E+07 3.9227392E-03 -1.8647176E-03 9.3004778E-04 5.0194470E-04 -2.7264522E-04 1.3714367E-04 5.3246864E-05 3 4.7561904E+06 7.0717605E-03 -3.3866771E-03 1.6914755E-03 9.1321350E-04 -4.9608808E-04 2.4954499E-04 9.6887617E-05 4 1.7878194E+06 1.1512852E-02 -5.5770862E-03 2.7913192E-03 1.5078393E-03 -8.1925114E-04 4.1212648E-04 1.6001383E-04 5 7.3627109E+05 1.8280632E-02 -8.9728585E-03 4.5016758E-03 2.4332595E-03 -1.3222822E-03 6.6520700E-04 2.5827575E-04 6 3.2094051E+05 2.8111493E-02 -1.4046443E-02 7.0694006E-03 3.8243477E-03 -2.0787987E-03 1.0458849E-03 4.0609392E-04 7 1.4766063E+05 4.2755369E-02 -2.1784636E-02 1.1002173E-02 5.9571469E-03 -3.2388351E-03 1.6296011E-03 6.3272609E-04 8 7.0743176E+04 6.3727459E-02 -3.3240450E-02 1.6856009E-02 9.1365630E-03 -4.9694424E-03 2.5007070E-03 9.7103051E-04 9 3.5263194E+04 9.2653276E-02 -4.9495683E-02 2.5208919E-02 1.3679036E-02 -7.4415056E-03 3.7447110E-03 1.4539495E-03 10 1.8190667E+04 1.2862134E-01 -7.0534609E-02 3.6088211E-02 1.9607572E-02 -1.0673637E-02 5.3727021E-03 2.0865339E-03 11 9.7321519E+03 1.6415992E-01 -9.1887825E-02 4.7200632E-02 2.5666045E-02 -1.3966973E-02 7.0283566E-03 2.7283328E-03 12 5.4211986E+03 1.8150707E-01 -1.0172356E-01 5.2009222E-02 2.8252217E-02 -1.5392847E-02 7.7526905E-03 3.0130575E-03 13 3.1880044E+03 1.6083136E-01 -7.9601553E-02 3.8705602E-02 2.0636826E-02 -1.1107577E-02 5.5621771E-03 2.1503428E-03 14 2.0150863E+03 1.0777809E-01 -2.7054406E-02 5.6624694E-03 1.7639032E-03 -8.9391867E-04 4.6762695E-04 2.0298342E-04 15 1.3642452E+03 6.5758599E-02 5.2545243E-02 -4.8523792E-02 -3.0495569E-02 1.7626373E-02 -9.0783994E-03 -3.5802986E-03 16 8.8552043E+02 3.2295468E-02 1.7723382E-01 -1.5491560E-01 -9.6378554E-02 5.4154117E-02 -2.7429887E-02 -1.0607426E-02 17 5.7259620E+02 5.2002790E-03 3.0460723E-01 -2.8414084E-01 -1.8304915E-01 1.0564695E-01 -5.4212441E-02 -2.1222781E-02 18 3.6218995E+02 1.2772587E-03 3.2978450E-01 -3.5986137E-01 -2.4027530E-01 1.3822641E-01 -7.0542144E-02 -2.7359252E-02 19 2.2469725E+02 -4.6791314E-04 1.9484285E-01 -1.2778920E-01 -7.3116472E-02 4.2724486E-02 -2.2263009E-02 -8.8703071E-03 20 1.3283457E+02 3.2303215E-04 4.5594776E-02 4.1667800E-01 4.7886733E-01 -3.3206946E-01 1.8002066E-01 7.1314636E-02 21 8.2014084E+01 -3.3888255E-04 -1.5661203E-03 5.9825254E-01 8.2200903E-01 -5.9018198E-01 3.2064859E-01 1.2601545E-01 22 5.0807501E+01 3.3650559E-04 3.1491317E-03 2.8701121E-01 3.3071646E-01 -2.3818809E-01 1.3778181E-01 5.6498162E-02 23 3.3163111E+01 -3.5122940E-04 -2.9813893E-03 4.4515540E-02 -4.5510169E-01 5.1421359E-01 -3.2472011E-01 -1.3515804E-01 24 2.2648064E+01 2.9727221E-04 2.2078840E-03 9.4123667E-03 -7.0332789E-01 1.0639847E+00 -7.4707211E-01 -3.0802015E-01 25 1.4901811E+01 -1.8090053E-04 -1.3547605E-03 -1.5804355E-03 -4.2293504E-01 6.1923784E-01 -4.0217539E-01 -1.6901854E-01 26 9.3244437E+00 9.9364943E-05 7.3790231E-04 8.3788794E-04 -6.9796384E-02 -6.3131459E-01 6.8116566E-01 3.0943069E-01 27 5.6332915E+00 -5.8105522E-05 -4.0928275E-04 -6.3663802E-04 -4.6524935E-03 -9.5819032E-01 1.2222112E+00 5.9445888E-01 28 3.1475933E+00 5.0569198E-05 3.6481025E-04 4.3320338E-04 1.1186283E-03 -2.8308965E-01 2.9622987E-01 1.6534108E-01 29 2.1911636E+00 -4.3523714E-05 -3.1399156E-04 -3.7585848E-04 -1.2902123E-03 2.6842464E-02 -6.8715081E-01 -5.0322446E-01 30 1.3604416E+00 2.2889098E-05 1.6403405E-04 2.0479027E-04 7.9678156E-04 -1.7333281E-02 -6.9267185E-01 -5.4859712E-01 31 8.4572106E-01 -1.1429297E-05 -8.2555298E-05 -9.8100037E-05 -3.8401450E-04 6.1235141E-03 -3.1601923E-01 -3.8038792E-01 32 5.2443017E-01 4.2153841E-06 3.0327005E-05 3.7378442E-05 1.5760073E-04 -1.9721777E-03 -6.4040208E-02 2.0488476E-01 33 2.5694204E-01 -9.8948888E-07 -7.1353207E-06 -8.6747158E-06 -3.6726402E-05 4.2452916E-04 -5.5756440E-03 6.6295615E-01 34 1.2561942E-01 2.8721225E-07 2.0788880E-06 2.4904917E-06 1.0687660E-05 -1.1753020E-04 4.6723237E-04 4.8404179E-01 35 5.5523221E-02 -5.3720915E-08 -3.8602271E-07 -4.8448059E-07 -2.1480787E-06 2.2040682E-05 -4.8053087E-05 8.0803382E-02 2p 3p 4p 5p 6p 7p 1 8.7168681E+07 6.6829373E-06 -3.6804840E-06 2.0272392E-06 -1.0814332E-06 -4.9268991E-07 -1.3229909E-07 2 3.7453243E+07 3.1488835E-05 -1.7332788E-05 9.5449332E-06 -5.0905988E-06 -2.3188221E-06 -6.2263805E-07 3 1.5852709E+07 7.1425759E-05 -3.9327972E-05 2.1660625E-05 -1.1554263E-05 -5.2638070E-06 -1.4134483E-06 4 6.8887365E+06 1.3688888E-04 -7.5406443E-05 4.1533531E-05 -2.2152220E-05 -1.0090668E-05 -2.7094973E-06 5 3.0664598E+06 2.4612365E-04 -1.3568608E-04 7.4756849E-05 -3.9881673E-05 -1.8169816E-05 -4.8790355E-06 6 1.3936076E+06 4.3241482E-04 -2.3865721E-04 1.3151641E-04 -7.0153435E-05 -3.1956302E-05 -8.5807571E-06 7 6.4459264E+05 7.5440880E-04 -4.1711643E-04 2.2999521E-04 -1.2273273E-04 -5.5921902E-05 -1.5016656E-05 8 3.0310118E+05 1.3221350E-03 -7.3294276E-04 4.0436487E-04 -2.1575699E-04 -9.8285389E-05 -2.6391241E-05 9 1.4483877E+05 2.3509800E-03 -1.3084795E-03 7.2277830E-04 -3.8592763E-04 -1.7588094E-04 -4.7230884E-05 10 7.0316897E+04 4.2885863E-03 -2.4002583E-03 1.3275236E-03 -7.0878309E-04 -3.2291380E-04 -8.6708960E-05 11 3.4670548E+04 8.0911410E-03 -4.5635759E-03 2.5298491E-03 -1.3523642E-03 -6.1655337E-04 -1.6557936E-04 12 1.7370584E+04 1.5794836E-02 -8.9980520E-03 4.9997189E-03 -2.6727714E-03 -1.2180086E-03 -3.2707297E-04 13 8.8579093E+03 3.1531532E-02 -1.8198101E-02 1.0150696E-02 -5.4366404E-03 -2.4800832E-03 -6.6610931E-04 14 4.6055784E+03 6.2706337E-02 -3.6806569E-02 2.0614977E-02 -1.1044955E-02 -5.0358831E-03 -1.3523965E-03 15 2.4436789E+03 1.1882596E-01 -7.1297586E-02 4.0196688E-02 -2.1600915E-02 -9.8639126E-03 -2.6497370E-03 16 1.3230504E+03 2.0100121E-01 -1.2373422E-01 7.0220777E-02 -3.7758447E-02 -1.7228987E-02 -4.6274001E-03 17 7.3153152E+02 2.7610105E-01 -1.7190829E-01 9.7918335E-02 -5.2814953E-02 -2.4153503E-02 -6.4900681E-03 18 4.1299565E+02 2.6964222E-01 -1.3946047E-01 7.2178111E-02 -3.7411556E-02 -1.6851221E-02 -4.5156900E-03 19 2.3736470E+02 1.5763072E-01 5.8964913E-02 -7.3771568E-02 4.6742006E-02 2.2144672E-02 5.9822884E-03 20 1.3897737E+02 4.2281091E-02 3.5434859E-01 -3.2747825E-01 2.0360853E-01 9.6881970E-02 2.6201197E-02 21 8.2586205E+01 3.9309485E-03 4.3498751E-01 -3.9794766E-01 2.4060730E-01 1.1271406E-01 3.0393648E-02 22 4.9065796E+01 -1.1047102E-04 2.2664513E-01 -7.6502866E-03 -4.1565710E-02 -2.4690527E-02 -6.8806931E-03 23 2.9308796E+01 2.5162448E-05 4.1077858E-02 5.2561374E-01 -5.3701039E-01 -2.9491772E-01 -8.1651192E-02 24 1.7748197E+01 -1.1428971E-04 2.8363871E-03 5.0470613E-01 -5.2398610E-01 -2.7647898E-01 -7.5863877E-02 25 1.0569152E+01 7.8405829E-05 -5.8010490E-04 1.5951480E-01 2.4438868E-01 2.1908447E-01 6.4526406E-02 26 6.2187668E+00 -4.1721415E-05 1.9513773E-04 1.2364442E-02 6.8736133E-01 5.8233511E-01 1.7360020E-01 27 3.6509163E+00 3.5846317E-05 -2.5719858E-04 1.6696531E-03 3.6694786E-01 2.6351157E-01 7.5778364E-02 28 2.1274583E+00 -2.3407232E-05 1.6267183E-04 -7.4757734E-04 6.3207247E-02 -3.6801910E-01 -1.4355021E-01 29 1.2356184E+00 1.4404020E-05 -9.8499305E-05 3.7836769E-04 3.9540727E-03 -5.4796546E-01 -2.2328723E-01 30 7.1521558E-01 -8.7363513E-06 6.1542472E-05 -2.5408958E-04 1.2594877E-04 -3.1909080E-01 -1.3652426E-01 31 4.0329089E-01 4.1237375E-06 -2.8940792E-05 1.1694920E-04 -6.0047248E-05 -8.7315329E-02 5.3837133E-02 32 2.0792017E-01 -1.7668467E-06 1.2452751E-05 -4.9180119E-05 -4.8284164E-05 -9.9827788E-03 2.9708776E-01 33 1.0170824E-01 7.5155517E-07 -5.3280830E-06 2.1654104E-05 -3.6671385E-06 -7.6975458E-04 4.4595321E-01 34 4.8219757E-02 -2.9150956E-07 2.0621658E-06 -8.1746998E-06 -5.2098566E-06 -2.2266107E-04 3.2673148E-01 35 2.2221568E-02 7.7107334E-08 -5.4755225E-07 2.2240069E-06 -5.3347707E-08 -2.2911474E-05 6.2692459E-02 3d 4d 5d 6d 1 1.2458824E+06 2.5918349E-06 -1.5749918E-06 8.1652474E-07 -2.9659251E-07 2 2.8490663E+05 1.2513508E-05 -7.6068868E-06 3.9434787E-06 -1.4325298E-06 3 8.7802543E+04 5.0518516E-05 -3.0770296E-05 1.5963106E-05 -5.7991314E-06 4 3.1870538E+04 1.8858767E-04 -1.1504777E-04 5.9697014E-05 -2.1690758E-05 5 1.2969100E+04 6.8153412E-04 -4.1739836E-04 2.1686788E-04 -7.8810056E-05 6 5.7636960E+03 2.3967452E-03 -1.4729007E-03 7.6579412E-04 -2.7837319E-04 7 2.7508794E+03 7.9856712E-03 -4.9394806E-03 2.5733794E-03 -9.3573661E-04 8 1.3906289E+03 2.4215813E-02 -1.5086664E-02 7.8734231E-03 -2.8644369E-03 9 7.3554061E+02 6.4485346E-02 -4.0729657E-02 2.1343728E-02 -7.7711903E-03 10 4.0377943E+02 1.4395407E-01 -9.1994894E-02 4.8341028E-02 -1.7613726E-02 11 2.2793463E+02 2.5194663E-01 -1.6012496E-01 8.4079729E-02 -3.0626809E-02 12 1.3161684E+02 3.1922617E-01 -1.8647005E-01 9.4806817E-02 -3.4267030E-02 13 7.7111759E+01 2.5586234E-01 -5.3048826E-02 5.5271023E-03 -4.9879078E-05 14 4.5482552E+01 1.1279203E-01 2.3071005E-01 -1.8028453E-01 7.0951597E-02 15 2.7017663E+01 2.0900442E-02 4.3964942E-01 -3.2973432E-01 1.2950082E-01 16 1.6116946E+01 1.3429550E-03 3.3011559E-01 -1.3876167E-01 3.9793212E-02 17 9.5374137E+00 -1.4367142E-04 1.0707837E-01 3.0458024E-01 -1.6283889E-01 18 5.5384663E+00 -4.2571656E-05 1.1858602E-02 5.0850456E-01 -2.6507633E-01 19 3.1655710E+00 -5.3540882E-05 6.1829507E-04 3.0599605E-01 -8.4859743E-02 20 1.7569544E+00 8.9139614E-06 -2.8659046E-05 7.2466010E-02 2.5058963E-01 21 9.4241219E-01 -7.4865503E-06 1.5910676E-05 5.1589726E-03 4.2974209E-01 22 4.8606519E-01 3.2319070E-06 -1.2575472E-05 3.9724315E-04 3.5488217E-01 23 2.3901036E-01 -1.2735665E-06 5.2042046E-06 -7.4520136E-05 1.5838870E-01 24 1.0633467E-01 3.0647271E-07 -8.8854905E-07 3.9606512E-06 2.4921625E-02 4f 5f 1 6.9737416E+03 4.8936147E-05 -2.4120480E-05 2 2.2290073E+03 4.6601503E-04 -2.3169216E-04 3 9.2124970E+02 2.9428281E-03 -1.4591579E-03 4 4.3389933E+02 1.3844211E-02 -6.9216109E-03 5 2.2194091E+02 4.8064809E-02 -2.4011691E-02 6 1.1925774E+02 1.2600701E-01 -6.3538995E-02 7 6.6405441E+01 2.4230686E-01 -1.1852855E-01 8 3.7580921E+01 3.3179222E-01 -1.4841315E-01 9 2.1544229E+01 2.9786954E-01 -7.2048113E-02 10 1.2321911E+01 1.5255576E-01 1.5335294E-01 11 6.9047998E+00 3.5935597E-02 3.6598016E-01 12 3.7888954E+00 2.2405866E-03 3.8479999E-01 13 2.0031370E+00 1.2674891E-04 2.2149609E-01 14 9.9243102E-01 -7.7277835E-05 6.0736459E-02 15 4.2886320E-01 1.0013590E-05 4.7803270E-03 16 1.6496259E-01 -4.9734844E-06 7.5249320E-05 Pseudo-large component functions -------------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2603380E+07 3.6001206E-05 -1.6934529E-05 8.4297458E-06 4.5471687E-06 -2.4695206E-06 1.2421351E-06 4.8225900E-07 2 1.3986165E+07 2.2315055E-04 -1.0499190E-04 5.2265290E-05 2.8193324E-05 -1.5311758E-05 7.7016745E-06 2.9902045E-06 3 4.7561904E+06 6.7443845E-04 -3.1777565E-04 1.5823600E-04 8.5362859E-05 -4.6360649E-05 2.3318874E-05 9.0535329E-06 4 1.7878194E+06 1.8287646E-03 -8.6284350E-04 4.2976289E-04 2.3186050E-04 -1.2592993E-04 6.3342799E-05 2.4593325E-05 5 7.3627109E+05 4.2554626E-03 -2.0117337E-03 1.0024503E-03 5.4088714E-04 -2.9376884E-04 1.4776353E-04 5.7368685E-05 6 3.2094051E+05 9.4294919E-03 -4.4685869E-03 2.2278480E-03 1.2022635E-03 -6.5304817E-04 3.2849519E-04 1.2754329E-04 7 1.4766063E+05 1.9153681E-02 -9.1096388E-03 4.5460465E-03 2.4538500E-03 -1.3328663E-03 6.7043321E-04 2.6028968E-04 8 7.0743176E+04 3.7034841E-02 -1.7710012E-02 8.8496123E-03 4.7787977E-03 -2.5963801E-03 1.3061379E-03 5.0715155E-04 9 3.5263194E+04 6.5826796E-02 -3.1737037E-02 1.5897821E-02 8.5900156E-03 -4.6669698E-03 2.3475939E-03 9.1139763E-04 10 1.8190667E+04 1.0823112E-01 -5.2820159E-02 2.6545164E-02 1.4358027E-02 -7.8059131E-03 3.9277829E-03 1.5253090E-03 11 9.7321519E+03 1.5574608E-01 -7.7004198E-02 3.8883576E-02 2.1053992E-02 -1.1442207E-02 5.7555656E-03 2.2339800E-03 12 5.4211986E+03 1.8988189E-01 -9.3893685E-02 4.7369217E-02 2.5656137E-02 -1.3967531E-02 7.0333848E-03 2.7334720E-03 13 3.1880044E+03 1.7694497E-01 -7.8938122E-02 3.8552624E-02 2.0613208E-02 -1.1107718E-02 5.5645813E-03 2.1517443E-03 14 2.0150863E+03 1.2671624E-01 -3.2931727E-02 1.0125388E-02 4.4805453E-03 -2.4208716E-03 1.2427030E-03 5.0392520E-04 15 1.3642452E+03 7.4668689E-02 4.6555139E-02 -4.2037007E-02 -2.6335862E-02 1.5246150E-02 -7.8618861E-03 -3.1054962E-03 16 8.8552043E+02 4.1948963E-02 1.6966932E-01 -1.4461626E-01 -8.9413228E-02 5.0117907E-02 -2.5362418E-02 -9.8025939E-03 17 5.7259620E+02 3.6122570E-03 3.0632884E-01 -2.7771537E-01 -1.7794373E-01 1.0256495E-01 -5.2613692E-02 -2.0596835E-02 18 3.6218995E+02 3.8503691E-03 3.3533548E-01 -3.5824877E-01 -2.3842333E-01 1.3703352E-01 -6.9914278E-02 -2.7114270E-02 19 2.2469725E+02 -2.4849581E-03 2.0166052E-01 -1.3394345E-01 -7.8757915E-02 4.6317538E-02 -2.4154894E-02 -9.6109581E-03 20 1.3283457E+02 2.2732880E-03 4.6435008E-02 4.1352801E-01 4.7157011E-01 -3.2637089E-01 1.7684204E-01 7.0051397E-02 21 8.2014084E+01 -2.6021210E-03 -6.7900207E-04 6.0117500E-01 8.2133466E-01 -5.8913804E-01 3.2001541E-01 1.2576271E-01 22 5.0807501E+01 3.2164145E-03 2.0461629E-03 2.8950545E-01 3.3324859E-01 -2.4048239E-01 1.3906953E-01 5.7004690E-02 23 3.3163111E+01 -4.0220874E-03 -1.5295361E-03 4.4740641E-02 -4.5352055E-01 5.1116074E-01 -3.2248734E-01 -1.3421112E-01 24 2.2648064E+01 3.9224521E-03 7.4472511E-04 9.7379471E-03 -7.0448159E-01 1.0636757E+00 -7.4658540E-01 -3.0780750E-01 25 1.4901811E+01 -2.8813984E-03 -2.4802373E-04 -1.7936584E-03 -4.2388700E-01 6.2029548E-01 -4.0307991E-01 -1.6940277E-01 26 9.3244437E+00 1.9543395E-03 -3.2212642E-05 9.8868709E-04 -7.0063562E-02 -6.3080275E-01 6.8023316E-01 3.0896363E-01 27 5.6332915E+00 -1.4241888E-03 1.6446486E-04 -7.5035768E-04 -4.6225831E-03 -9.5873724E-01 1.2222789E+00 5.9444305E-01 28 3.1475933E+00 1.6454231E-03 -3.1168007E-04 5.6650929E-04 1.0780156E-03 -2.8326360E-01 2.9648722E-01 1.6551244E-01 29 2.1911636E+00 -1.6924511E-03 3.8893826E-04 -5.1388356E-04 -1.2496167E-03 2.6819280E-02 -6.8718417E-01 -5.0318513E-01 30 1.3604416E+00 1.1313280E-03 -3.1109194E-04 2.9764941E-04 7.6996357E-04 -1.7316437E-02 -6.9273276E-01 -5.4857840E-01 31 8.4572106E-01 -7.2721367E-04 2.2560770E-04 -1.5799160E-04 -3.6665196E-04 6.1085716E-03 -3.1607082E-01 -3.8041184E-01 32 5.2443017E-01 3.4805364E-04 -1.1822731E-04 6.6113259E-05 1.4922793E-04 -1.9641641E-03 -6.4046738E-02 2.0487596E-01 33 2.5694204E-01 -1.2319352E-04 4.5871615E-05 -1.8864425E-05 -3.3715924E-05 4.2143993E-04 -5.5769121E-03 6.6295806E-01 34 1.2561942E-01 5.5534596E-05 -2.1950655E-05 7.0880572E-06 9.3114828E-06 -1.1606916E-04 4.6754547E-04 4.8404859E-01 35 5.5523221E-02 -1.7926387E-05 7.4039970E-06 -1.9693375E-06 -1.6989534E-06 2.1553521E-05 -4.8135574E-05 8.0804235E-02 2p 3p 4p 5p 6p 7p 1 8.7168681E+07 4.4007957E-08 -2.4256379E-08 1.3372957E-08 -7.1454779E-09 -3.2598962E-09 -8.7560153E-10 2 3.7453243E+07 3.1456551E-07 -1.7343855E-07 9.5508462E-08 -5.0892866E-08 -2.3162804E-08 -6.2185010E-09 3 1.5852709E+07 1.1610974E-06 -6.4078734E-07 3.5327851E-07 -1.8864621E-07 -8.6011958E-08 -2.3099828E-08 4 6.8887365E+06 3.5076862E-06 -1.9377054E-06 1.0676535E-06 -5.6907801E-07 -2.5904642E-07 -6.9548195E-08 5 3.0664598E+06 9.7895577E-06 -5.4175687E-06 2.9889257E-06 -1.5963424E-06 -7.2786603E-07 -1.9548046E-07 6 1.3936076E+06 2.6364757E-05 -1.4618189E-05 8.0622470E-06 -4.2985784E-06 -1.9568967E-06 -5.2539070E-07 7 6.4459264E+05 6.9931498E-05 -3.8882819E-05 2.1478017E-05 -1.1474894E-05 -5.2324561E-06 -1.4052778E-06 8 3.0310118E+05 1.8427137E-04 -1.0276247E-04 5.6761950E-05 -3.0278823E-05 -1.3786468E-05 -3.7015170E-06 9 1.4483877E+05 4.8413782E-04 -2.7103357E-04 1.4997330E-04 -8.0160593E-05 -3.6555284E-05 -9.8177260E-06 10 7.0316897E+04 1.2689034E-03 -7.1331610E-04 3.9484371E-04 -2.1077136E-04 -9.5991343E-05 -2.5773738E-05 11 3.4670548E+04 3.3031405E-03 -1.8667821E-03 1.0354741E-03 -5.5380626E-04 -2.5257730E-04 -6.7836163E-05 12 1.7370584E+04 8.4455844E-03 -4.8044375E-03 2.6678894E-03 -1.4255880E-03 -6.4946600E-04 -1.7439180E-04 13 8.8579093E+03 2.0830944E-02 -1.1964695E-02 6.6654097E-03 -3.5692650E-03 -1.6283379E-03 -4.3735252E-04 14 4.6055784E+03 4.8368743E-02 -2.8176527E-02 1.5748261E-02 -8.4312775E-03 -3.8431022E-03 -1.0320204E-03 15 2.4436789E+03 1.0196737E-01 -6.0647364E-02 3.4116923E-02 -1.8323727E-02 -8.3666679E-03 -2.2475086E-03 16 1.3230504E+03 1.8481654E-01 -1.1282051E-01 6.3894036E-02 -3.4333824E-02 -1.5662889E-02 -4.2066131E-03 17 7.3153152E+02 2.6481722E-01 -1.6401607E-01 9.3357350E-02 -5.0350469E-02 -2.3026812E-02 -6.1873566E-03 18 4.1299565E+02 2.6409465E-01 -1.3731158E-01 7.1502764E-02 -3.7153226E-02 -1.6747150E-02 -4.4883469E-03 19 2.3736470E+02 1.5378316E-01 5.6701767E-02 -7.0773303E-02 4.4793120E-02 2.1210950E-02 5.7295304E-03 20 1.3897737E+02 3.7525183E-02 3.5262507E-01 -3.2408577E-01 2.0125381E-01 9.5735288E-02 2.5890027E-02 21 8.2586205E+01 -1.0759159E-03 4.3624747E-01 -3.9792918E-01 2.4057863E-01 1.1270439E-01 3.0391242E-02 22 4.9065796E+01 -4.5881477E-03 2.2788219E-01 -9.7459778E-03 -3.9709630E-02 -2.3723679E-02 -6.6153270E-03 23 2.9308796E+01 -3.8434844E-03 4.1439517E-02 5.2431731E-01 -5.3523748E-01 -2.9388594E-01 -8.1363256E-02 24 1.7748197E+01 -3.4709924E-03 2.8089336E-03 5.0478877E-01 -5.2406636E-01 -2.7658812E-01 -7.5897547E-02 25 1.0569152E+01 -3.0796006E-03 -5.2861353E-04 1.5913927E-01 2.4407749E-01 2.1868983E-01 6.4405628E-02 26 6.2187668E+00 -2.7238447E-03 1.6426730E-04 1.1916647E-02 6.8747782E-01 5.8220877E-01 1.7355403E-01 27 3.6509163E+00 -2.4703133E-03 -2.1712591E-04 1.1363789E-03 3.6720125E-01 2.6368750E-01 7.5834780E-02 28 2.1274583E+00 -2.0469771E-03 1.3953408E-04 -1.1073149E-03 6.3253235E-02 -3.6792340E-01 -1.4350727E-01 29 1.2356184E+00 -2.0410893E-03 -6.8810705E-05 -5.4942676E-05 4.0250167E-03 -5.4790160E-01 -2.2326001E-01 30 7.1521558E-01 -1.4188930E-03 4.7086328E-05 -5.0716576E-04 1.3863619E-04 -3.1907358E-01 -1.3651880E-01 31 4.0329089E-01 -1.8977452E-03 -1.1709585E-05 -2.7081610E-04 -6.5609910E-06 -8.7249308E-02 5.3848582E-02 32 2.0792017E-01 -1.1573904E-03 8.4519197E-06 -2.6655331E-04 -2.9974650E-05 -9.9473167E-03 2.9709260E-01 33 1.0170824E-01 -1.9276882E-03 4.4710391E-06 -3.6182558E-04 4.2960802E-05 -7.0081909E-04 4.4596692E-01 34 4.8219757E-02 -2.5516455E-04 6.0579219E-08 -5.4714865E-05 -2.2365756E-06 -2.1532004E-04 3.2673364E-01 35 2.2221568E-02 -2.2409859E-03 6.7559444E-06 -4.3828456E-04 5.0161655E-05 5.5017550E-05 6.2707885E-02 3d 4d 5d 6d 1 1.2458824E+06 1.0657864E-07 -6.4973928E-08 3.3732486E-08 -1.2252161E-08 2 2.8490663E+05 1.2446970E-06 -7.5717994E-07 3.9243816E-07 -1.4259319E-07 3 8.7802543E+04 9.9408600E-06 -6.0723007E-06 3.1534943E-06 -1.1456573E-06 4 3.1870538E+04 6.3862175E-05 -3.8991598E-05 2.0233562E-05 -7.3527649E-06 5 1.2969100E+04 3.4427886E-04 -2.1093913E-04 1.0961802E-04 -3.9834331E-05 6 5.7636960E+03 1.5871842E-03 -9.7426734E-04 5.0636320E-04 -1.8405972E-04 7 2.7508794E+03 6.2744006E-03 -3.8739906E-03 2.0173113E-03 -7.3344561E-04 8 1.3906289E+03 2.1098080E-02 -1.3114322E-02 6.8398620E-03 -2.4881044E-03 9 7.3554061E+02 5.9714164E-02 -3.7628346E-02 1.9706182E-02 -7.1739187E-03 10 4.0377943E+02 1.3815025E-01 -8.8120102E-02 4.6283177E-02 -1.6862298E-02 11 2.2793463E+02 2.4672391E-01 -1.5662775E-01 8.2221495E-02 -2.9948087E-02 12 1.3161684E+02 3.1622487E-01 -1.8482791E-01 9.4028819E-02 -3.3991884E-02 13 7.7111759E+01 2.5476114E-01 -5.3599065E-02 6.1283290E-03 -2.9659651E-04 14 4.5482552E+01 1.1214343E-01 2.2942079E-01 -1.7916604E-01 7.0501598E-02 15 2.7017663E+01 2.0277040E-02 4.3900413E-01 -3.2910563E-01 1.2924980E-01 16 1.6116946E+01 8.3060551E-04 3.3009937E-01 -1.3903465E-01 3.9950369E-02 17 9.5374137E+00 -4.8987805E-04 1.0697877E-01 3.0421817E-01 -1.6262475E-01 18 5.5384663E+00 -2.9244021E-04 1.1735830E-02 5.0836008E-01 -2.6497852E-01 19 3.1655710E+00 -2.1356412E-04 5.0554647E-04 3.0598041E-01 -8.4893592E-02 20 1.7569544E+00 -1.0897289E-04 -9.4017423E-05 7.2412621E-02 2.5054963E-01 21 9.4241219E-01 -7.7547575E-05 -3.4154953E-05 5.1240294E-03 4.2971953E-01 22 4.8606519E-01 -5.0768453E-05 -4.2767804E-05 3.6401129E-04 3.5487575E-01 23 2.3901036E-01 -2.5597683E-05 -1.2247218E-05 -8.7068481E-05 1.5838508E-01 24 1.0633467E-01 -2.8994728E-05 -1.8453246E-05 -1.3345294E-05 2.4916433E-02 4f 5f 1 6.9737416E+03 2.7672115E-05 -1.3603210E-05 2 2.2290073E+03 3.6187727E-04 -1.7998870E-04 3 9.2124970E+02 2.6003957E-03 -1.2883878E-03 4 4.3389933E+02 1.3006133E-02 -6.5002129E-03 5 2.2194091E+02 4.6552724E-02 -2.3245315E-02 6 1.1925774E+02 1.2398006E-01 -6.2498465E-02 7 6.6405441E+01 2.4037648E-01 -1.1757523E-01 8 3.7580921E+01 3.3052642E-01 -1.4787581E-01 9 2.1544229E+01 2.9738813E-01 -7.2084961E-02 10 1.2321911E+01 1.5239398E-01 1.5302861E-01 11 6.9047998E+00 3.5846306E-02 3.6572213E-01 12 3.7888954E+00 2.1788520E-03 3.8469269E-01 13 2.0031370E+00 9.8728904E-05 2.2146136E-01 14 9.9243102E-01 -9.2448227E-05 6.0719400E-02 15 4.2886320E-01 4.5936497E-06 4.7713495E-03 16 1.6496259E-01 -7.3895376E-06 7.1854539E-05 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2603380E+07 4.2639038E-03 -2.0293427E-03 1.0100427E-03 5.4482926E-04 -2.9586349E-04 1.4882007E-04 5.7777769E-05 2 1.3986165E+07 8.6786288E-03 -4.1444677E-03 2.0642251E-03 1.1136845E-03 -6.0481249E-04 3.0422864E-04 1.1811544E-04 3 4.7561904E+06 1.4319393E-02 -6.8666102E-03 3.4228945E-03 1.8471231E-03 -1.0031784E-03 5.0461506E-04 1.9590977E-04 4 1.7878194E+06 2.1640866E-02 -1.0454789E-02 5.2186838E-03 2.8172749E-03 -1.5302869E-03 7.6979582E-04 2.9887426E-04 5 7.3627109E+05 3.1726489E-02 -1.5474342E-02 7.7383726E-03 4.1793963E-03 -2.2704582E-03 1.1422339E-03 4.4347228E-04 6 3.2094051E+05 4.5142849E-02 -2.2341796E-02 1.1203340E-02 6.0550084E-03 -3.2901294E-03 1.6553099E-03 6.4271752E-04 7 1.4766063E+05 6.3424060E-02 -3.1957750E-02 1.6082778E-02 8.6990529E-03 -4.7261859E-03 2.3772125E-03 9.2285116E-04 8 7.0743176E+04 8.7478160E-02 -4.5139065E-02 2.2823999E-02 1.2365173E-02 -6.7252923E-03 3.3847750E-03 1.3144226E-03 9 3.5263194E+04 1.1825333E-01 -6.2638391E-02 3.1849926E-02 1.7285684E-02 -9.4042742E-03 4.7322616E-03 1.8371821E-03 10 1.8190667E+04 1.5386900E-01 -8.3993845E-02 4.2931618E-02 2.3314741E-02 -1.2690103E-02 6.3885360E-03 2.4815974E-03 11 9.7321519E+03 1.8596678E-01 -1.0406927E-01 5.3455419E-02 2.9061583E-02 -1.5812978E-02 7.9558749E-03 3.0873420E-03 12 5.4211986E+03 1.9636728E-01 -1.1060913E-01 5.6699365E-02 3.0819707E-02 -1.6797168E-02 8.4594353E-03 3.2892534E-03 13 3.1880044E+03 1.6686048E-01 -8.3048194E-02 4.0579437E-02 2.1654337E-02 -1.1648167E-02 5.8297686E-03 2.2502016E-03 14 2.0150863E+03 1.0676122E-01 -2.5925548E-02 4.9638974E-03 1.3612804E-03 -7.0837100E-04 3.8530519E-04 1.7999616E-04 15 1.3642452E+03 6.3260577E-02 5.7363936E-02 -5.1663349E-02 -3.2350793E-02 1.8674166E-02 -9.6126131E-03 -3.7991294E-03 16 8.8552043E+02 2.9997924E-02 1.8444528E-01 -1.6090579E-01 -1.0011885E-01 5.6274594E-02 -2.8518064E-02 -1.1021419E-02 17 5.7259620E+02 3.5362127E-03 3.1117941E-01 -2.9083423E-01 -1.8765115E-01 1.0835267E-01 -5.5601003E-02 -2.1774072E-02 18 3.6218995E+02 7.6234336E-04 3.3161505E-01 -3.6398822E-01 -2.4348548E-01 1.4014643E-01 -7.1539053E-02 -2.7740995E-02 19 2.2469725E+02 -7.3084850E-04 1.9295533E-01 -1.2464949E-01 -7.1153536E-02 4.1661807E-02 -2.1722896E-02 -8.6656124E-03 20 1.3283457E+02 2.5549933E-04 4.4154512E-02 4.2223831E-01 4.8469558E-01 -3.3607929E-01 1.8218338E-01 7.2172454E-02 21 8.2014084E+01 -4.0642658E-04 -2.0497429E-03 5.9979760E-01 8.2498281E-01 -5.9248647E-01 3.2192731E-01 1.2651686E-01 22 5.0807501E+01 3.3356936E-04 3.1082611E-03 2.8593268E-01 3.2901620E-01 -2.3712814E-01 1.3728872E-01 5.6319494E-02 23 3.3163111E+01 -3.8642980E-04 -3.0648584E-03 4.3982968E-02 -4.5728337E-01 5.1636598E-01 -3.2606783E-01 -1.3571788E-01 24 2.2648064E+01 3.0437872E-04 2.2202996E-03 9.2971860E-03 -7.0393758E-01 1.0654862E+00 -7.4825674E-01 -3.0851144E-01 25 1.4901811E+01 -1.9475727E-04 -1.3816267E-03 -1.5938151E-03 -4.2257456E-01 6.1860944E-01 -4.0169634E-01 -1.6882787E-01 26 9.3244437E+00 1.0148268E-04 7.4232096E-04 8.3149713E-04 -6.9552415E-02 -6.3227112E-01 6.8200730E-01 3.0980143E-01 27 5.6332915E+00 -6.1301532E-05 -4.1339197E-04 -6.4281168E-04 -4.6214738E-03 -9.5829659E-01 1.2224519E+00 5.9459636E-01 28 3.1475933E+00 5.1995887E-05 3.6800772E-04 4.2762695E-04 1.1289686E-03 -2.8295312E-01 2.9602121E-01 1.6524873E-01 29 2.1911636E+00 -4.5215109E-05 -3.1662843E-04 -3.7831663E-04 -1.2897554E-03 2.6902201E-02 -6.8733674E-01 -5.0335298E-01 30 1.3604416E+00 2.3575192E-05 1.6479871E-04 2.0384399E-04 8.0046003E-04 -1.7361310E-02 -6.9264009E-01 -5.4858909E-01 31 8.4572106E-01 -1.1791957E-05 -8.3631563E-05 -9.8660903E-05 -3.8113826E-04 6.1264725E-03 -3.1600330E-01 -3.8038581E-01 32 5.2443017E-01 4.3528315E-06 3.0240618E-05 3.7258923E-05 1.5488342E-04 -1.9656892E-03 -6.4035293E-02 2.0490685E-01 33 2.5694204E-01 -1.0259373E-06 -7.2970782E-06 -9.2281399E-06 -3.7348398E-05 4.2462421E-04 -5.5751558E-03 6.6296147E-01 34 1.2561942E-01 2.8343642E-07 1.9926902E-06 2.9116472E-06 1.1546592E-05 -1.1817213E-04 4.6890160E-04 4.8404102E-01 35 5.5523221E-02 -6.2921368E-08 -4.0902300E-07 -5.3470194E-07 -2.2696273E-06 2.2267358E-05 -4.8230775E-05 8.0802357E-02 2p 3p 4p 5p 6p 7p 1 8.7168681E+07 2.9708594E-06 -1.6329656E-06 9.0570974E-07 -4.8617911E-07 -2.2265522E-07 -5.9849593E-08 2 3.7453243E+07 2.7343074E-05 -1.4994202E-05 8.2521584E-06 -4.3928792E-06 -1.9976177E-06 -5.3620091E-07 3 1.5852709E+07 6.5805091E-05 -3.6156426E-05 1.9943591E-05 -1.0657515E-05 -4.8630063E-06 -1.3062389E-06 4 6.8887365E+06 1.3149508E-04 -7.2260348E-05 3.9788430E-05 -2.1188800E-05 -9.6379782E-06 -2.5871692E-06 5 3.0664598E+06 2.4650020E-04 -1.3584352E-04 7.4974691E-05 -4.0067899E-05 -1.8281646E-05 -4.9105058E-06 6 1.3936076E+06 4.5167884E-04 -2.4920810E-04 1.3735702E-04 -7.3178986E-05 -3.3293178E-05 -8.9374025E-06 7 6.4459264E+05 8.2000710E-04 -4.5408716E-04 2.5086872E-04 -1.3408870E-04 -6.1175417E-05 -1.6431597E-05 8 3.0310118E+05 1.4866295E-03 -8.2537654E-04 4.5563185E-04 -2.4290296E-04 -1.1054367E-04 -2.9676689E-05 9 1.4483877E+05 2.7080954E-03 -1.5112847E-03 8.3633256E-04 -4.4715585E-04 -2.0399345E-04 -5.4791272E-05 10 7.0316897E+04 4.9929741E-03 -2.8005491E-03 1.5499644E-03 -8.2710971E-04 -3.7656530E-04 -1.0110075E-04 11 3.4670548E+04 9.3785434E-03 -5.3023550E-03 2.9433167E-03 -1.5748105E-03 -7.1845681E-04 -1.9297209E-04 12 1.7370584E+04 1.7988097E-02 -1.0264261E-02 5.7061931E-03 -3.0496263E-03 -1.3891966E-03 -3.7301129E-04 13 8.8579093E+03 3.5018460E-02 -2.0243236E-02 1.1300848E-02 -6.0558352E-03 -2.7636176E-03 -7.4231924E-04 14 4.6055784E+03 6.7838185E-02 -3.9877709E-02 2.2346115E-02 -1.1971606E-02 -5.4573498E-03 -1.4655215E-03 15 2.4436789E+03 1.2557999E-01 -7.5494325E-02 4.2595958E-02 -2.2898652E-02 -1.0458791E-02 -2.8096514E-03 16 1.3230504E+03 2.0834178E-01 -1.2856793E-01 7.3027945E-02 -3.9274032E-02 -1.7919622E-02 -4.8128268E-03 17 7.3153152E+02 2.8166829E-01 -1.7592740E-01 1.0033612E-01 -5.4146213E-02 -2.4768042E-02 -6.6554816E-03 18 4.1299565E+02 2.7144448E-01 -1.4050215E-01 7.2747719E-02 -3.7704791E-02 -1.6980123E-02 -4.5500522E-03 19 2.3736470E+02 1.5684425E-01 6.1276558E-02 -7.5550663E-02 4.7778890E-02 2.2624283E-02 6.1113382E-03 20 1.3897737E+02 4.1484645E-02 3.5745532E-01 -3.3039348E-01 2.0546680E-01 9.7775730E-02 2.6443384E-02 21 8.2586205E+01 3.7462607E-03 4.3586472E-01 -3.9898950E-01 2.4127323E-01 1.1302698E-01 3.0478043E-02 22 4.9065796E+01 -1.4584986E-04 2.2619267E-01 -6.5159825E-03 -4.2377066E-02 -2.5079348E-02 -6.9858780E-03 23 2.9308796E+01 2.1182309E-05 4.0795017E-02 5.2681714E-01 -5.3828107E-01 -2.9563957E-01 -8.1852153E-02 24 1.7748197E+01 -1.1981091E-04 2.8013073E-03 5.0473153E-01 -5.2407956E-01 -2.7652183E-01 -7.5875181E-02 25 1.0569152E+01 7.9042190E-05 -5.9192861E-04 1.5933909E-01 2.4494561E-01 2.1945314E-01 6.4631142E-02 26 6.2187668E+00 -4.3209232E-05 1.9728442E-04 1.2314247E-02 6.8755492E-01 5.8252709E-01 1.7365990E-01 27 3.6509163E+00 3.6439303E-05 -2.6040677E-04 1.6699966E-03 3.6688754E-01 2.6344684E-01 7.5758590E-02 28 2.1274583E+00 -2.3844981E-05 1.6370735E-04 -7.5249251E-04 6.3181148E-02 -3.6810404E-01 -1.4358077E-01 29 1.2356184E+00 1.4649034E-05 -9.9443485E-05 3.8051000E-04 3.9486402E-03 -5.4798403E-01 -2.2329621E-01 30 7.1521558E-01 -8.9050328E-06 6.1969034E-05 -2.5557266E-04 1.2619254E-04 -3.1908383E-01 -1.3652257E-01 31 4.0329089E-01 4.1902985E-06 -2.9156660E-05 1.1754180E-04 -6.0590060E-05 -8.7311397E-02 5.3841116E-02 32 2.0792017E-01 -1.7995831E-06 1.2535809E-05 -4.9454950E-05 -4.8128349E-05 -9.9820345E-03 2.9709078E-01 33 1.0170824E-01 7.6453992E-07 -5.3673000E-06 2.1765052E-05 -3.7532679E-06 -7.6963275E-04 4.4595431E-01 34 4.8219757E-02 -2.9678779E-07 2.0762286E-06 -8.2189114E-06 -5.1785973E-06 -2.2263155E-04 3.2673129E-01 35 2.2221568E-02 7.8361765E-08 -5.5141504E-07 2.2360082E-06 -6.8090257E-08 -2.2914752E-05 6.2692284E-02 3d 4d 5d 6d 1 1.2458824E+06 2.7577998E-06 -1.6692221E-06 8.6310391E-07 -3.1303608E-07 2 2.8490663E+05 1.3812636E-05 -8.3975780E-06 4.3595352E-06 -1.5853351E-06 3 8.7802543E+04 5.7343394E-05 -3.4861179E-05 1.8060113E-05 -6.5554226E-06 4 3.1870538E+04 2.1540392E-04 -1.3145854E-04 6.8268493E-05 -2.4818629E-05 5 1.2969100E+04 7.6414867E-04 -4.6766605E-04 2.4284490E-04 -8.8218605E-05 6 5.7636960E+03 2.6153724E-03 -1.6074128E-03 8.3598441E-04 -3.0394966E-04 7 2.7508794E+03 8.4938996E-03 -5.2530529E-03 2.7363427E-03 -9.9488748E-04 8 1.3906289E+03 2.5255322E-02 -1.5736800E-02 8.2138034E-03 -2.9884903E-03 9 7.3554061E+02 6.6295765E-02 -4.1887835E-02 2.1952504E-02 -7.9928070E-03 10 4.0377943E+02 1.4649905E-01 -9.3670521E-02 4.9230050E-02 -1.7938599E-02 11 2.2793463E+02 2.5451616E-01 -1.6185183E-01 8.5004591E-02 -3.0964992E-02 12 1.3161684E+02 3.2081059E-01 -1.8747791E-01 9.5334382E-02 -3.4459142E-02 13 7.7111759E+01 2.5613386E-01 -5.2725814E-02 5.2502405E-03 6.0445244E-05 14 4.5482552E+01 1.1261195E-01 2.3163348E-01 -1.8094113E-01 7.1207527E-02 15 2.7017663E+01 2.0800742E-02 4.4025970E-01 -3.3024504E-01 1.2970758E-01 16 1.6116946E+01 1.3330364E-03 3.3012669E-01 -1.3864074E-01 3.9727191E-02 17 9.5374137E+00 -1.4727368E-04 1.0700847E-01 3.0486965E-01 -1.6297940E-01 18 5.5384663E+00 -4.1707563E-05 1.1836466E-02 5.0862231E-01 -2.6514531E-01 19 3.1655710E+00 -5.4218895E-05 6.1831138E-04 3.0598174E-01 -8.4835654E-02 20 1.7569544E+00 9.1988829E-06 -2.9926817E-05 7.2454011E-02 2.5062583E-01 21 9.4241219E-01 -7.6447712E-06 1.6386020E-05 5.1565438E-03 4.2975786E-01 22 4.8606519E-01 3.2968596E-06 -1.2815474E-05 3.9735862E-04 3.5488408E-01 23 2.3901036E-01 -1.2976173E-06 5.2861737E-06 -7.4639965E-05 1.5838784E-01 24 1.0633467E-01 3.1242720E-07 -9.1013657E-07 3.9830980E-06 2.4921319E-02 4f 5f 1 6.9737416E+03 5.4176244E-05 -2.6659567E-05 2 2.2290073E+03 4.9351095E-04 -2.4544721E-04 3 9.2124970E+02 3.0423453E-03 -1.5082266E-03 4 4.3389933E+02 1.4126492E-02 -7.0633084E-03 5 2.2194091E+02 4.8647810E-02 -2.4303818E-02 6 1.1925774E+02 1.2689225E-01 -6.3994486E-02 7 6.6405441E+01 2.4323833E-01 -1.1898960E-01 8 3.7580921E+01 3.3242326E-01 -1.4870272E-01 9 2.1544229E+01 2.9807958E-01 -7.2047664E-02 10 1.2321911E+01 1.5254925E-01 1.5354650E-01 11 6.9047998E+00 3.5917188E-02 3.6613072E-01 12 3.7888954E+00 2.2374495E-03 3.8485306E-01 13 2.0031370E+00 1.2673978E-04 2.2149862E-01 14 9.9243102E-01 -7.7334880E-05 6.0734128E-02 15 4.2886320E-01 1.0026465E-05 4.7799799E-03 16 1.6496259E-01 -4.9772649E-06 7.5236798E-05 ** Uup 291 ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2491197E+07 1.8964802E-03 -9.0128433E-04 4.4920371E-04 2.4264267E-04 -1.3221074E-04 6.7111711E-05 2.6897874E-05 2 1.3955363E+07 4.1609638E-03 -1.9907607E-03 9.9344872E-04 5.3680011E-04 -2.9252093E-04 1.4849165E-04 5.9514674E-05 3 4.7444073E+06 7.4762151E-03 -3.6039418E-03 1.8010081E-03 9.7351354E-04 -5.3055604E-04 2.6933264E-04 1.0794806E-04 4 1.7823406E+06 1.2126701E-02 -5.9140167E-03 2.9617387E-03 1.6018306E-03 -8.7314039E-04 4.4326753E-04 1.7766243E-04 5 7.3341245E+05 1.9183302E-02 -9.4809660E-03 4.7596567E-03 2.5758384E-03 -1.4042991E-03 7.1295298E-04 2.8575717E-04 6 3.1928682E+05 2.9392509E-02 -1.4790917E-02 7.4492117E-03 4.0347807E-03 -2.2003179E-03 1.1171916E-03 4.4778533E-04 7 1.4662612E+05 4.4560501E-02 -2.2870553E-02 1.1559078E-02 6.2664475E-03 -3.4180537E-03 1.7355608E-03 6.9564940E-04 8 7.0043918E+04 6.6274750E-02 -3.4825374E-02 1.7672872E-02 9.5913177E-03 -5.2338351E-03 2.6579752E-03 1.0653970E-03 9 3.4760996E+04 9.6202760E-02 -5.1770395E-02 2.6386633E-02 1.4335716E-02 -7.8239307E-03 3.9732372E-03 1.5926122E-03 10 1.7833590E+04 1.3299620E-01 -7.3401665E-02 3.7572831E-02 2.0438556E-02 -1.1162553E-02 5.6706739E-03 2.2731240E-03 11 9.4934630E+03 1.6791760E-01 -9.4337164E-02 4.8446271E-02 2.6366932E-02 -1.4391732E-02 7.3074430E-03 2.9290248E-03 12 5.2796348E+03 1.8049587E-01 -1.0042588E-01 5.1123911E-02 2.7770924E-02 -1.5182072E-02 7.7199328E-03 3.0950874E-03 13 3.1613072E+03 1.4554888E-01 -6.9605562E-02 3.3282493E-02 1.7632281E-02 -9.4619157E-03 4.7613064E-03 1.9050456E-03 14 2.0871349E+03 1.0274467E-01 -2.3871817E-02 3.9192731E-03 8.3258814E-04 -4.2100444E-04 2.5363121E-04 1.0436479E-04 15 1.3628922E+03 7.3423848E-02 6.7397760E-02 -6.1681032E-02 -3.8763060E-02 2.2415255E-02 -1.1654060E-02 -4.6944668E-03 16 8.5007168E+02 2.6997025E-02 2.1193055E-01 -1.8637576E-01 -1.1644805E-01 6.5719906E-02 -3.3571134E-02 -1.3475452E-02 17 5.4996428E+02 4.1505753E-03 2.9547172E-01 -2.8087785E-01 -1.8262218E-01 1.0633460E-01 -5.5280326E-02 -2.2271669E-02 18 3.6017841E+02 5.9236186E-04 3.0044544E-01 -3.3037881E-01 -2.2067578E-01 1.2679568E-01 -6.5036417E-02 -2.6128245E-02 19 2.2738767E+02 -8.3446584E-05 1.8495356E-01 -1.0639015E-01 -5.6553999E-02 3.3293090E-02 -1.7807662E-02 -7.2194136E-03 20 1.3445737E+02 1.4200670E-05 4.2175405E-02 4.3857739E-01 5.0920270E-01 -3.5618225E-01 1.9553302E-01 7.9747562E-02 21 8.2390838E+01 -4.0837073E-05 -1.1872208E-03 5.9973176E-01 8.2855818E-01 -5.9656308E-01 3.2674021E-01 1.3316456E-01 22 5.0525006E+01 2.5942541E-05 2.4571347E-03 2.6689854E-01 2.8220053E-01 -2.0475474E-01 1.2342309E-01 5.1625894E-02 23 3.3042925E+01 -1.9957058E-05 -2.2633644E-03 3.4894839E-02 -5.3344075E-01 6.2997236E-01 -4.1314967E-01 -1.7577000E-01 24 2.2129136E+01 2.0472688E-05 1.6253933E-03 8.8466210E-03 -7.1014611E-01 1.0981488E+00 -7.7786060E-01 -3.3540941E-01 25 1.4478426E+01 -1.1610047E-05 -1.0899833E-03 -2.1757214E-03 -3.5157494E-01 4.7735645E-01 -3.0063399E-01 -1.2660422E-01 26 9.3507147E+00 6.0887434E-06 6.2859389E-04 1.0572329E-03 -5.0599252E-02 -7.0149327E-01 7.6227848E-01 3.5466252E-01 27 5.6894382E+00 -3.7553108E-06 -3.1654621E-04 -6.7355705E-04 -5.8200799E-03 -9.1691793E-01 1.2124900E+00 6.2617634E-01 28 3.2643861E+00 2.2225496E-06 2.1627952E-04 3.5176139E-04 1.5226738E-03 -2.4556570E-01 1.6612975E-01 7.1303738E-02 29 2.0835764E+00 -1.6076490E-06 -1.6113669E-04 -2.5743910E-04 -1.2579783E-03 4.8235112E-03 -8.0611017E-01 -6.0661937E-01 30 1.2547722E+00 1.0268050E-06 9.7878278E-05 1.6465958E-04 8.3932425E-04 -8.4767510E-03 -6.4298958E-01 -6.1786459E-01 31 7.8143289E-01 -5.5801804E-07 -5.5768190E-05 -8.8896690E-05 -4.4852183E-04 3.5485119E-03 -2.1027935E-01 -1.8274921E-01 32 4.5486372E-01 2.5032682E-07 2.4692278E-05 4.0194522E-05 2.0915453E-04 -1.3530837E-03 -3.2560028E-02 3.0323245E-01 33 2.6422197E-01 -9.5599046E-08 -9.4189468E-06 -1.5315290E-05 -8.0046001E-05 4.8226276E-04 1.1824671E-04 6.0817184E-01 34 1.3717656E-01 2.3584078E-08 2.3874554E-06 3.7940533E-06 1.9911160E-05 -1.1481085E-04 -3.5100321E-04 4.4551609E-01 35 6.1400603E-02 -3.8580799E-09 -3.6969994E-07 -6.1958686E-07 -3.3111189E-06 1.8014386E-05 1.1192372E-04 7.3304983E-02 2p 3p 4p 5p 6p 7p 1 8.8595892E+07 6.5956843E-06 -3.6389169E-06 2.0083488E-06 -1.0757591E-06 4.9717039E-07 -1.4669878E-07 2 3.8521084E+07 3.1669116E-05 -1.7462475E-05 9.6353730E-06 -5.1599076E-06 2.3842257E-06 -7.0347293E-07 3 1.6451656E+07 7.2179821E-05 -3.9812142E-05 2.1970741E-05 -1.1767758E-05 5.4383131E-06 -1.6046510E-06 4 7.1926190E+06 1.3840235E-04 -7.6372275E-05 4.2148615E-05 -2.2572501E-05 1.0430130E-05 -3.0774457E-06 5 3.2161149E+06 2.4847200E-04 -1.3721668E-04 7.5749754E-05 -4.0577052E-05 1.8752991E-05 -5.5333860E-06 6 1.4669872E+06 4.3525626E-04 -2.4063644E-04 1.3286843E-04 -7.1165456E-05 3.2883943E-05 -9.7025130E-06 7 6.8071175E+05 7.5650964E-04 -4.1898043E-04 2.3147821E-04 -1.2403006E-04 5.7327400E-05 -1.6915776E-05 8 3.2096276E+05 1.3201801E-03 -7.3305585E-04 4.0521696E-04 -2.1709874E-04 1.0031999E-04 -2.9599777E-05 9 1.5366839E+05 2.3378598E-03 -1.3032040E-03 7.2126353E-04 -3.8669237E-04 1.7876949E-04 -5.2752325E-05 10 7.4655896E+04 4.2467792E-03 -2.3803651E-03 1.3190431E-03 -7.0714378E-04 3.2680306E-04 -9.6425529E-05 11 3.6795374E+04 7.9755954E-03 -4.5045866E-03 2.5019064E-03 -1.3428736E-03 6.2105327E-04 -1.8327750E-04 12 1.8406518E+04 1.5517716E-02 -8.8516365E-03 4.9275991E-03 -2.6450289E-03 1.2227118E-03 -3.6078280E-04 13 9.3577219E+03 3.0948431E-02 -1.7882633E-02 9.9933532E-03 -5.3741081E-03 2.4869225E-03 -7.3399234E-04 14 4.8469532E+03 6.1540380E-02 -3.6158172E-02 2.0288353E-02 -1.0914498E-02 5.0479955E-03 -1.4896143E-03 15 2.5640376E+03 1.1654580E-01 -6.9973738E-02 3.9518985E-02 -2.1322526E-02 9.8774684E-03 -2.9158079E-03 16 1.3868465E+03 1.9709816E-01 -1.2134527E-01 6.8970373E-02 -3.7235163E-02 1.7233819E-02 -5.0860127E-03 17 7.6774319E+02 2.7195759E-01 -1.6948590E-01 9.6728776E-02 -5.2390238E-02 2.4308584E-02 -7.1782947E-03 18 4.3488315E+02 2.6972778E-01 -1.4261069E-01 7.4802126E-02 -3.9098227E-02 1.7880014E-02 -5.2640831E-03 19 2.5133617E+02 1.6374024E-01 4.1740461E-02 -6.0401638E-02 3.9021291E-02 -1.8788896E-02 5.5782474E-03 20 1.4826094E+02 4.7855549E-02 3.2793044E-01 -3.0337181E-01 1.8940806E-01 -9.1532424E-02 2.7223504E-02 21 8.8947607E+01 5.1151855E-03 4.3462163E-01 -4.0316559E-01 2.4658512E-01 -1.1738584E-01 3.4790174E-02 22 5.3289873E+01 3.5506318E-06 2.5181190E-01 -6.9195084E-02 5.3861018E-03 1.0611099E-03 -4.6383594E-04 23 3.1997441E+01 -1.9970813E-05 5.4018624E-02 4.7379229E-01 -4.8126827E-01 2.6784963E-01 -8.1657594E-02 24 1.9489552E+01 -8.9046214E-05 3.8959460E-03 5.3945087E-01 -5.8101595E-01 3.1751093E-01 -9.6179315E-02 25 1.1674663E+01 5.2980150E-05 -3.9048927E-04 1.9906369E-01 1.3385707E-01 -1.4758756E-01 4.8699967E-02 26 6.8825431E+00 -2.2765004E-05 9.1038025E-05 1.9836982E-02 6.8523098E-01 -5.8447963E-01 1.9217672E-01 27 4.0384544E+00 2.3180043E-05 -2.0726416E-04 1.7023684E-03 4.2825021E-01 -3.4774235E-01 1.1322737E-01 28 2.3349338E+00 -1.4044011E-05 1.2153950E-04 -5.9674144E-04 8.2003622E-02 3.3703134E-01 -1.4823141E-01 29 1.3354373E+00 8.2591386E-06 -7.1503742E-05 2.8521170E-04 5.0002117E-03 5.8706514E-01 -2.6852524E-01 30 7.6046347E-01 -5.4892234E-06 4.8918232E-05 -2.1806095E-04 1.8023452E-05 3.3002267E-01 -1.5852630E-01 31 4.3020400E-01 2.8314962E-06 -2.5462756E-05 1.1196743E-04 1.1268269E-05 8.0883017E-02 7.8352001E-02 32 2.2986305E-01 -1.3466945E-06 1.2113044E-05 -5.1716067E-05 -9.8243353E-05 9.6592847E-03 3.2891243E-01 33 1.1658824E-01 5.8412830E-07 -5.2926585E-06 2.3486263E-05 1.2842452E-05 9.3680368E-04 4.4510564E-01 34 5.6626962E-02 -2.1430355E-07 1.9447709E-06 -8.2940529E-06 -1.5983786E-05 3.5256972E-04 2.9675785E-01 35 2.6358431E-02 5.5011815E-08 -4.9937654E-07 2.2149727E-06 1.7060314E-06 3.0768614E-05 5.1030344E-02 3d 4d 5d 6d 1 1.2616748E+06 2.6951063E-06 -1.6428655E-06 8.5716617E-07 -3.2287295E-07 2 2.8662303E+05 1.3133281E-05 -8.0083036E-06 4.1774348E-06 -1.5733819E-06 3 8.7855770E+04 5.3269680E-05 -3.2549411E-05 1.6995379E-05 -6.4029137E-06 4 3.1791722E+04 1.9930667E-04 -1.2197081E-04 6.3682532E-05 -2.3989930E-05 5 1.2905853E+04 7.2217075E-04 -4.4375257E-04 2.3206953E-04 -8.7463081E-05 6 5.7257848E+03 2.5397020E-03 -1.5659293E-03 8.1925910E-04 -3.0876583E-04 7 2.7318216E+03 8.4311718E-03 -5.2333916E-03 2.7445427E-03 -1.0350258E-03 8 1.3816948E+03 2.5407474E-02 -1.5885631E-02 8.3431062E-03 -3.1471363E-03 9 7.3169894E+02 6.7079969E-02 -4.2533872E-02 2.2440238E-02 -8.4743251E-03 10 4.0235578E+02 1.4807803E-01 -9.4926973E-02 5.0192191E-02 -1.8961548E-02 11 2.2748096E+02 2.5602681E-01 -1.6305378E-01 8.6169139E-02 -3.2555814E-02 12 1.3150853E+02 3.1941084E-01 -1.8522889E-01 9.4255437E-02 -3.5256528E-02 13 7.7038004E+01 2.5100664E-01 -4.2802639E-02 -1.3721770E-03 2.7182280E-03 14 4.5388023E+01 1.0709489E-01 2.4557348E-01 -1.9248922E-01 7.8754459E-02 15 2.6994011E+01 1.8646225E-02 4.4233880E-01 -3.3339224E-01 1.3571336E-01 16 1.6114236E+01 1.2547074E-03 3.1848177E-01 -1.1825997E-01 3.1163862E-02 17 9.5457064E+00 -2.1902262E-04 9.8621992E-02 3.2505203E-01 -1.8063163E-01 18 5.5737719E+00 -3.9523804E-07 1.0256843E-02 5.0378957E-01 -2.7396328E-01 19 3.2100412E+00 -7.4295279E-05 6.2383489E-04 2.9093809E-01 -7.2181971E-02 20 1.7999468E+00 2.1988065E-05 -6.9606303E-05 6.7079134E-02 2.7110148E-01 21 9.7727630E-01 -1.3687587E-05 3.1495755E-05 4.6259274E-03 4.4012873E-01 22 5.1139672E-01 6.0306858E-06 -1.8302660E-05 3.2397451E-04 3.4181845E-01 23 2.5468564E-01 -2.3240530E-06 8.0804390E-06 -8.9491586E-05 1.3761292E-01 24 1.1303759E-01 5.4319418E-07 -1.2895002E-06 -2.3609757E-06 1.8672396E-02 4f 5f 1 7.2916097E+03 4.7263791E-05 -2.3631137E-05 2 2.3263015E+03 4.4841017E-04 -2.2619076E-04 3 9.6023538E+02 2.8326602E-03 -1.4247708E-03 4 4.5183580E+02 1.3369015E-02 -6.7813871E-03 5 2.3099948E+02 4.6692759E-02 -2.3664033E-02 6 1.2410346E+02 1.2324395E-01 -6.3058823E-02 7 6.9117564E+01 2.3915311E-01 -1.1885191E-01 8 3.9140259E+01 3.3063462E-01 -1.5059283E-01 9 2.2462698E+01 3.0037427E-01 -7.6471565E-02 10 1.2874500E+01 1.5614142E-01 1.4942163E-01 11 7.2447405E+00 3.7689998E-02 3.6457772E-01 12 4.0088311E+00 2.4867207E-03 3.8373651E-01 13 2.1533604E+00 1.4339682E-04 2.2156724E-01 14 1.0944519E+00 -8.2758739E-05 6.2587400E-02 15 4.8241565E-01 9.6184310E-06 5.1852380E-03 16 1.7263001E-01 -4.4611830E-06 2.1397771E-05 Pseudo-large component functions -------------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2491197E+07 3.8107832E-05 -1.8039107E-05 8.9841279E-06 4.8519310E-06 -2.6435422E-06 1.3418635E-06 5.3780602E-07 2 1.3955363E+07 2.3574400E-04 -1.1161981E-04 5.5592731E-05 3.0023662E-05 -1.6358511E-05 8.3036950E-06 3.3280507E-06 3 4.7444073E+06 7.1082191E-04 -3.3705138E-04 1.6792049E-04 9.0694316E-05 -4.9415187E-05 2.5083252E-05 1.0053134E-05 4 1.7823406E+06 1.9225688E-03 -9.1286965E-04 4.5491291E-04 2.4571994E-04 -1.3388912E-04 6.7964556E-05 2.7239751E-05 5 7.3341245E+05 4.4622895E-03 -2.1229148E-03 1.0583996E-03 5.7174991E-04 -3.1153284E-04 1.5813538E-04 6.3379254E-05 6 3.1928682E+05 9.8664237E-03 -4.7048861E-03 2.3468371E-03 1.2679779E-03 -6.9097428E-04 3.5076578E-04 1.4058593E-04 7 1.4662612E+05 2.0009534E-02 -9.5751044E-03 4.7807087E-03 2.5835426E-03 -1.4078277E-03 7.1462526E-04 2.8641601E-04 8 7.0043918E+04 3.8675591E-02 -1.8601617E-02 9.2993193E-03 5.0275629E-03 -2.7404076E-03 1.3912755E-03 5.5763137E-04 9 3.4760996E+04 6.8767031E-02 -3.3331580E-02 1.6703461E-02 9.0356521E-03 -4.9247682E-03 2.4999039E-03 1.0019460E-03 10 1.7833590E+04 1.1278029E-01 -5.5263726E-02 2.7778848E-02 1.5042458E-02 -8.2047811E-03 4.1666570E-03 1.6701244E-03 11 9.4934630E+03 1.6066635E-01 -7.9555712E-02 4.0161512E-02 2.1765503E-02 -1.1864514E-02 6.0216039E-03 2.4133324E-03 12 5.2796348E+03 1.9055332E-01 -9.3439679E-02 4.6979989E-02 2.5453984E-02 -1.3906164E-02 7.0703290E-03 2.8347327E-03 13 3.1613072E+03 1.6071400E-01 -6.9456604E-02 3.3512187E-02 1.7834757E-02 -9.5898739E-03 4.8288716E-03 1.9319415E-03 14 2.0871349E+03 1.2133943E-01 -2.9722479E-02 8.3889207E-03 3.5602132E-03 -1.9581700E-03 1.0419167E-03 4.2174360E-04 15 1.3628922E+03 8.4566019E-02 5.9960250E-02 -5.3655712E-02 -3.3602301E-02 1.9449945E-02 -1.0125561E-02 -4.0806746E-03 16 8.5007168E+02 3.5706870E-02 2.0496542E-01 -1.7550694E-01 -1.0895417E-01 6.1343290E-02 -3.1303832E-02 -1.2561530E-02 17 5.4996428E+02 1.9563233E-03 2.9842922E-01 -2.7560520E-01 -1.7825907E-01 1.0366564E-01 -5.3880395E-02 -2.1707810E-02 18 3.6017841E+02 3.5544599E-03 3.0572796E-01 -3.2927329E-01 -2.1926423E-01 1.2587315E-01 -6.4543529E-02 -2.5927238E-02 19 2.2738767E+02 -2.3156933E-03 1.9177854E-01 -1.1279341E-01 -6.2565305E-02 3.7160036E-02 -1.9868955E-02 -8.0556225E-03 20 1.3445737E+02 1.9990985E-03 4.2934979E-02 4.3562900E-01 5.0181807E-01 -3.5033271E-01 1.9223054E-01 7.8393472E-02 21 8.2390838E+01 -2.2391226E-03 -3.2752834E-04 6.0291432E-01 8.2816378E-01 -5.9573810E-01 3.2622148E-01 1.3294680E-01 22 5.0525006E+01 2.8149482E-03 1.3904607E-03 2.6932296E-01 2.8495653E-01 -2.0735105E-01 1.2491504E-01 5.2239369E-02 23 3.3042925E+01 -3.5081473E-03 -8.9534806E-04 3.5069236E-02 -5.3213041E-01 6.2690712E-01 -4.1079687E-01 -1.7473632E-01 24 2.2129136E+01 3.5207077E-03 2.3045723E-04 9.1388696E-03 -7.1146764E-01 1.0981456E+00 -7.7762719E-01 -3.3529621E-01 25 1.4478426E+01 -2.9010374E-03 7.3848469E-05 -2.3876351E-03 -3.5242259E-01 4.7845443E-01 -3.0162736E-01 -1.2704924E-01 26 9.3507147E+00 2.0864107E-03 -2.1588513E-04 1.2109749E-03 -5.0812628E-02 -7.0111088E-01 7.6140512E-01 3.5419808E-01 27 5.6894382E+00 -1.4111330E-03 2.5899087E-04 -7.7918200E-04 -5.7992182E-03 -9.1746500E-01 1.2125820E+00 6.2616930E-01 28 3.2643861E+00 1.2474494E-03 -2.9594192E-04 4.4519145E-04 1.4975343E-03 -2.4574367E-01 1.6639746E-01 7.1502408E-02 29 2.0835764E+00 -1.1661409E-03 3.1967742E-04 -3.4477729E-04 -1.2344339E-03 4.8085813E-03 -8.0615726E-01 -6.0657067E-01 30 1.2547722E+00 9.3030624E-04 -2.8711917E-04 2.3432389E-04 8.2030984E-04 -8.4674323E-03 -6.4306254E-01 -6.1785928E-01 31 7.8143289E-01 -6.7810884E-04 2.2564337E-04 -1.3958566E-04 -4.3434601E-04 3.5392628E-03 -2.1031957E-01 -1.8277911E-01 32 4.5486372E-01 4.0649933E-04 -1.4442073E-04 7.0524452E-05 2.0048243E-04 -1.3467551E-03 -3.2561258E-02 3.0322949E-01 33 2.6422197E-01 -2.1284162E-04 7.9299280E-05 -3.1166394E-05 -7.5419996E-05 4.7871535E-04 1.1670100E-04 6.0817582E-01 34 1.3717656E-01 8.0779827E-05 -3.1341930E-05 9.7979178E-06 1.8122021E-05 -1.1339685E-04 -3.5047801E-04 4.4552352E-01 35 6.1400603E-02 -2.1803389E-05 8.7474535E-06 -2.2371374E-06 -2.8206298E-06 1.7619353E-05 1.1178541E-04 7.3305905E-02 2p 3p 4p 5p 6p 7p 1 8.8595892E+07 4.3344747E-08 -2.3932065E-08 1.3221350E-08 -7.0937762E-09 3.2835188E-09 -9.6923909E-10 2 3.8521084E+07 3.1354464E-07 -1.7317898E-07 9.5550631E-08 -5.1123802E-08 2.3600712E-08 -6.9617934E-09 3 1.6451656E+07 1.1569466E-06 -6.3959256E-07 3.5332804E-07 -1.8944589E-07 8.7627239E-08 -2.5861356E-08 4 7.1926190E+06 3.4865493E-06 -1.9293493E-06 1.0651221E-06 -5.7006436E-07 2.6321538E-07 -7.7647525E-08 5 3.2161149E+06 9.6887953E-06 -5.3708207E-06 2.9690433E-06 -1.5922002E-06 7.3647886E-07 -2.1735648E-07 6 1.4669872E+06 2.5948657E-05 -1.4411778E-05 7.9638770E-06 -4.2636202E-06 1.9688208E-06 -5.8080457E-07 7 6.8071175E+05 6.8395389E-05 -3.8091393E-05 2.1082664E-05 -1.1309665E-05 5.2317008E-06 -1.5440432E-06 8 3.2096276E+05 1.7908728E-04 -1.0003749E-04 5.5364250E-05 -2.9654915E-05 1.3696128E-05 -4.0405084E-06 9 1.5366839E+05 4.6814564E-04 -2.6250920E-04 1.4554474E-04 -7.8111305E-05 3.6135761E-05 -1.0664888E-05 10 7.4655896E+04 1.2228584E-03 -6.8857076E-04 3.8189056E-04 -2.0469809E-04 9.4564302E-05 -2.7898958E-05 11 3.6795374E+04 3.1773862E-03 -1.7986117E-03 9.9963437E-04 -5.3682132E-04 2.4836844E-04 -7.3302597E-05 12 1.8406518E+04 8.1322301E-03 -4.6334056E-03 2.5778981E-03 -1.3831888E-03 6.3920911E-04 -1.8859593E-04 13 9.3577219E+03 2.0142886E-02 -1.1585326E-02 6.4664073E-03 -3.4767809E-03 1.6090492E-03 -4.7491032E-04 14 4.8469532E+03 4.6992874E-02 -2.7404356E-02 1.5344440E-02 -8.2487765E-03 3.8139677E-03 -1.1253956E-03 15 2.5640376E+03 9.9373152E-02 -5.9138492E-02 3.3325235E-02 -1.7970591E-02 8.3239938E-03 -2.4572082E-03 16 1.3868465E+03 1.8051723E-01 -1.1019241E-01 6.2498333E-02 -3.3718399E-02 1.5602512E-02 -4.6043752E-03 17 7.6774319E+02 2.6023793E-01 -1.6128525E-01 9.1974750E-02 -4.9809214E-02 2.3111241E-02 -6.8247656E-03 18 4.3488315E+02 2.6390103E-01 -1.4015349E-01 7.3915959E-02 -3.8720397E-02 1.7718959E-02 -5.2172725E-03 19 2.5133617E+02 1.5988616E-01 3.9605112E-02 -5.7531845E-02 3.7147745E-02 -1.7878341E-02 5.3072981E-03 20 1.4826094E+02 4.3174174E-02 3.2597027E-01 -2.9980804E-01 1.8693799E-01 -9.0311761E-02 2.6859231E-02 21 8.8947607E+01 7.4989699E-05 4.3569711E-01 -4.0279961E-01 2.4629903E-01 -1.1724837E-01 3.4749442E-02 22 5.3289873E+01 -4.5707584E-03 2.5316619E-01 -7.1231425E-02 7.1478855E-03 1.3824689E-04 -1.8565556E-04 23 3.1997441E+01 -3.9950742E-03 5.4466699E-02 4.7225477E-01 -4.7929873E-01 2.6669568E-01 -8.1303205E-02 24 1.9489552E+01 -3.5242347E-03 3.8787532E-03 5.3948516E-01 -5.8090176E-01 3.1748683E-01 -9.6174793E-02 25 1.1674663E+01 -3.2089856E-03 -3.4699275E-04 1.9875477E-01 1.3346877E-01 -1.4714568E-01 4.8552075E-02 26 6.8825431E+00 -2.8073731E-03 6.2908402E-05 1.9374466E-02 6.8530710E-01 -5.8429752E-01 1.9210558E-01 27 4.0384544E+00 -2.5989934E-03 -1.7591465E-04 1.1549621E-03 4.2852138E-01 -3.4790966E-01 1.1328533E-01 28 2.3349338E+00 -2.1667248E-03 1.0254060E-04 -9.9200224E-04 8.2072834E-02 3.3690764E-01 -1.4817224E-01 29 1.3354373E+00 -2.1833937E-03 -4.9110382E-05 -1.6818264E-04 5.0658528E-03 5.8700228E-01 -2.6849307E-01 30 7.6046347E-01 -1.4662533E-03 3.6173052E-05 -4.8662602E-04 3.6716052E-05 3.3000123E-01 -1.5851912E-01 31 4.3020400E-01 -1.9739250E-03 -1.1209932E-05 -2.8963132E-04 6.3157442E-05 8.0815207E-02 7.8363645E-02 32 2.2986305E-01 -9.8947862E-04 6.6007582E-06 -2.3718382E-04 -8.2871263E-05 9.6275680E-03 3.2891704E-01 33 1.1658824E-01 -2.1000443E-03 2.6035063E-06 -3.9449488E-04 6.1847003E-05 8.6082536E-04 4.4512204E-01 34 5.6626962E-02 -1.2756722E-04 -3.8829831E-07 -3.0240097E-05 -1.5326588E-05 3.4901880E-04 2.9675958E-01 35 2.6358431E-02 -2.4224838E-03 4.5040748E-06 -4.7486400E-04 5.4820423E-05 -5.5334138E-05 5.1048546E-02 3d 4d 5d 6d 1 1.2616748E+06 1.1074249E-07 -6.7739246E-08 3.5420301E-08 -1.3351114E-08 2 2.8662303E+05 1.3067409E-06 -7.9726077E-07 4.1554863E-07 -1.5645998E-07 3 8.7855770E+04 1.0503478E-05 -6.4373035E-06 3.3660034E-06 -1.2686556E-06 4 3.1791722E+04 6.7640355E-05 -4.1426367E-05 2.1625722E-05 -8.1458925E-06 5 1.2905853E+04 3.6561493E-04 -2.2476130E-04 1.1757991E-04 -4.4318270E-05 6 5.7257848E+03 1.6849105E-03 -1.0376298E-03 5.4262875E-04 -2.0448507E-04 7 2.7318216E+03 6.6330609E-03 -4.1097504E-03 2.1542893E-03 -8.1234976E-04 8 1.3816948E+03 2.2153993E-02 -1.3819164E-02 7.2530527E-03 -2.7355421E-03 9 7.3169894E+02 6.2147959E-02 -3.9313918E-02 2.0728446E-02 -7.8267820E-03 10 4.0235578E+02 1.4214929E-01 -9.0954373E-02 4.8068651E-02 -1.8157415E-02 11 2.2748096E+02 2.5076729E-01 -1.5952642E-01 8.4283646E-02 -3.1841646E-02 12 1.3150853E+02 3.1645335E-01 -1.8365289E-01 9.3520022E-02 -3.4988851E-02 13 7.7038004E+01 2.4992308E-01 -4.3440668E-02 -7.0112800E-04 2.4334701E-03 14 4.5388023E+01 1.0643833E-01 2.4425089E-01 -1.9132637E-01 7.8267316E-02 15 2.6994011E+01 1.8011722E-02 4.4172883E-01 -3.3279519E-01 1.3546786E-01 16 1.6114236E+01 7.4085240E-04 3.1847024E-01 -1.1857152E-01 3.1348661E-02 17 9.5457064E+00 -5.6618942E-04 9.8517577E-02 3.2468732E-01 -1.8040366E-01 18 5.5737719E+00 -2.4872644E-04 1.0131156E-02 5.0365295E-01 -2.7386692E-01 19 3.2100412E+00 -2.3462995E-04 5.1143917E-04 2.9092343E-01 -7.2223113E-02 20 1.7999468E+00 -9.6274347E-05 -1.3604068E-04 6.7023977E-02 2.7105842E-01 21 9.7727630E-01 -8.4389689E-05 -1.8793706E-05 4.5905592E-03 4.4010567E-01 22 5.1139672E-01 -4.9313720E-05 -4.9710461E-05 2.8947242E-04 3.4181256E-01 23 2.5468564E-01 -2.7650025E-05 -9.8752712E-06 -1.0267388E-04 1.3760891E-01 24 1.1303759E-01 -3.0378773E-05 -2.0045537E-05 -2.0766737E-05 1.8666426E-02 4f 5f 1 7.2916097E+03 2.6305309E-05 -1.3115414E-05 2 2.3263015E+03 3.4524691E-04 -1.7422939E-04 3 9.6023538E+02 2.4917239E-03 -1.2522995E-03 4 4.5183580E+02 1.2529063E-02 -6.3529241E-03 5 2.3099948E+02 4.5164593E-02 -2.2878352E-02 6 1.2410346E+02 1.2117623E-01 -6.1981632E-02 7 6.9117564E+01 2.3716192E-01 -1.1785218E-01 8 3.9140259E+01 3.2931367E-01 -1.5002000E-01 9 2.2462698E+01 2.9986538E-01 -7.6499651E-02 10 1.2874500E+01 1.5597244E-01 1.4908343E-01 11 7.2447405E+00 3.7597712E-02 3.6430617E-01 12 4.0088311E+00 2.4223684E-03 3.8362374E-01 13 2.1533604E+00 1.1386489E-04 2.2153116E-01 14 1.0944519E+00 -9.9120192E-05 6.2569250E-02 15 4.8241565E-01 3.2201769E-06 5.1748182E-03 16 1.7263001E-01 -7.1956578E-06 1.7436453E-05 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2491197E+07 4.5224469E-03 -2.1648886E-03 1.0778673E-03 5.8207061E-04 -3.1710276E-04 1.6096561E-04 6.4511605E-05 2 1.3955363E+07 9.1835873E-03 -4.4114864E-03 2.1980265E-03 1.1872187E-03 -6.4682363E-04 3.2834530E-04 1.3159450E-04 3 4.7444073E+06 1.5106702E-02 -7.2876478E-03 3.6341748E-03 1.9633817E-03 -1.0697462E-03 5.4302699E-04 2.1763226E-04 4 1.7823406E+06 2.2755489E-02 -1.1060977E-02 5.5237064E-03 2.9853777E-03 -1.6268787E-03 8.2593713E-04 3.3103070E-04 5 7.3341245E+05 3.3248044E-02 -1.6318977E-02 8.1644638E-03 4.4145523E-03 -2.4058366E-03 1.2214161E-03 4.8954664E-04 6 3.1928682E+05 4.7152442E-02 -2.3489729E-02 1.1785727E-02 6.3768077E-03 -3.4754815E-03 1.7642984E-03 7.0708108E-04 7 1.4662612E+05 6.6042818E-02 -3.3503239E-02 1.6872392E-02 9.1397871E-03 -4.9830159E-03 2.5296360E-03 1.0138178E-03 8 7.0043918E+04 9.0888080E-02 -4.7226179E-02 2.3900199E-02 1.2969926E-02 -7.0799494E-03 3.5967199E-03 1.4417621E-03 9 3.4760996E+04 1.2263006E-01 -6.5398082E-02 3.3252708E-02 1.8057527E-02 -9.8538011E-03 5.0040556E-03 2.0058330E-03 10 1.7833590E+04 1.5888077E-01 -8.7251559E-02 4.4585548E-02 2.4226326E-02 -1.3225024E-02 6.7184427E-03 2.6932672E-03 11 9.4934630E+03 1.8998277E-01 -1.0672849E-01 5.4822218E-02 2.9826811E-02 -1.6272222E-02 8.2591038E-03 3.3100517E-03 12 5.2796348E+03 1.9497300E-01 -1.0915591E-01 5.5785511E-02 3.0343834E-02 -1.6601782E-02 8.4423698E-03 3.3844568E-03 13 3.1613072E+03 1.4970646E-01 -7.2021604E-02 3.4672620E-02 1.8408276E-02 -9.8665180E-03 4.9600162E-03 1.9851575E-03 14 2.0871349E+03 1.0193176E-01 -2.2851645E-02 3.3070037E-03 4.9303935E-04 -2.8827877E-04 2.0244080E-04 8.4281840E-05 15 1.3628922E+03 7.1786179E-02 7.3256252E-02 -6.5821932E-02 -4.1253016E-02 2.3841820E-02 -1.2392390E-02 -4.9904264E-03 16 8.5007168E+02 2.4147727E-02 2.2023237E-01 -1.9345918E-01 -1.2092314E-01 6.8257893E-02 -3.4880684E-02 -1.4004636E-02 17 5.4996428E+02 2.6985793E-03 3.0049774E-01 -2.8639030E-01 -1.8654664E-01 1.0869568E-01 -5.6512819E-02 -2.2766312E-02 18 3.6017841E+02 -3.1120336E-05 3.0192267E-01 -3.3408344E-01 -2.2359304E-01 1.2852903E-01 -6.5936254E-02 -2.6492346E-02 19 2.2738767E+02 -2.6674793E-04 1.8319788E-01 -1.0312738E-01 -5.4454957E-02 3.2149312E-02 -1.7228280E-02 -6.9858520E-03 20 1.3445737E+02 -7.4937339E-05 4.0726853E-02 4.4428693E-01 5.1533829E-01 -3.6045179E-01 1.9786869E-01 8.0698462E-02 21 8.2390838E+01 -6.2257187E-05 -1.6564670E-03 6.0111430E-01 8.3132530E-01 -5.9872437E-01 3.2794192E-01 1.3365620E-01 22 5.0525006E+01 -5.7649213E-06 2.4088553E-03 2.6575874E-01 2.8033339E-01 -2.0362128E-01 1.2292573E-01 5.1437675E-02 23 3.3042925E+01 -2.0724290E-05 -2.3560548E-03 3.4394860E-02 -5.3577522E-01 6.3252136E-01 -4.1484857E-01 -1.7649622E-01 24 2.2129136E+01 8.5518880E-08 1.6473944E-03 8.7562184E-03 -7.1051446E-01 1.0993167E+00 -7.7879512E-01 -3.3581860E-01 25 1.4478426E+01 -7.8950895E-06 -1.1268123E-03 -2.1855528E-03 -3.5118268E-01 4.7661077E-01 -3.0008313E-01 -1.2636991E-01 26 9.3507147E+00 -1.8761414E-06 6.4063913E-04 1.0407883E-03 -5.0386020E-02 -7.0242896E-01 7.6315646E-01 3.5506379E-01 27 5.6894382E+00 -2.0015624E-06 -3.2422160E-04 -6.7629752E-04 -5.8057366E-03 -9.1695889E-01 1.2126789E+00 6.2630474E-01 28 3.2643861E+00 -2.2244118E-07 2.2084162E-04 3.4486889E-04 1.5393216E-03 -2.4543560E-01 1.6587617E-01 7.1166928E-02 29 2.0835764E+00 -3.0756029E-07 -1.6483810E-04 -2.5609822E-04 -1.2568773E-03 4.8637212E-03 -8.0626460E-01 -6.0673180E-01 30 1.2547722E+00 6.8025808E-08 9.9382514E-05 1.6250181E-04 8.4277268E-04 -8.4906357E-03 -6.4295497E-01 -6.1785899E-01 31 7.8143289E-01 -5.5531159E-08 -5.7117768E-05 -8.9009358E-05 -4.4760167E-04 3.5534193E-03 -2.1026466E-01 -1.8273041E-01 32 4.5486372E-01 2.6623386E-08 2.4985587E-05 3.9697595E-05 2.0798377E-04 -1.3504330E-03 -3.2556725E-02 3.0324724E-01 33 2.6422197E-01 -2.0317311E-08 -9.7155148E-06 -1.5614158E-05 -8.0404938E-05 4.8235619E-04 1.2025430E-04 6.0817751E-01 34 1.3717656E-01 -4.4253243E-09 2.3395209E-06 3.9956554E-06 2.0492646E-05 -1.1523824E-04 -3.5065175E-04 4.4551396E-01 35 6.1400603E-02 -6.1393793E-09 -4.0605459E-07 -6.3756241E-07 -3.3702754E-06 1.8188849E-05 1.1189218E-04 7.3303993E-02 2p 3p 4p 5p 6p 7p 1 8.8595892E+07 2.7719813E-06 -1.5277665E-06 8.4921416E-07 -4.5747256E-07 2.1248916E-07 -6.2774516E-08 2 3.8521084E+07 2.7415566E-05 -1.5065317E-05 8.3107116E-06 -4.4440282E-06 2.0504165E-06 -6.0475116E-07 3 1.6451656E+07 6.6453974E-05 -3.6579497E-05 2.0213320E-05 -1.0842256E-05 5.0175837E-06 -1.4810143E-06 4 7.1926190E+06 1.3288747E-04 -7.3170926E-05 4.0381535E-05 -2.1601038E-05 9.9690855E-06 -2.9404826E-06 5 3.2161149E+06 2.4870208E-04 -1.3729914E-04 7.5914917E-05 -4.0723349E-05 1.8844693E-05 -5.5621769E-06 6 1.4669872E+06 4.5426191E-04 -2.5111760E-04 1.3871892E-04 -7.4233354E-05 3.4265912E-05 -1.0107507E-05 7 6.8071175E+05 8.2146554E-04 -4.5567256E-04 2.5220536E-04 -1.3531717E-04 6.2614730E-05 -1.8480944E-05 8 3.2096276E+05 1.4831430E-03 -8.2494798E-04 4.5638574E-04 -2.4437278E-04 1.1283219E-04 -3.3284398E-05 9 1.5366839E+05 2.6922224E-03 -1.5048286E-03 8.3429862E-04 -4.4779373E-04 2.0720048E-04 -6.1154929E-05 10 7.4655896E+04 4.9475271E-03 -2.7796388E-03 1.5416070E-03 -8.2620149E-04 3.8161393E-04 -1.1258093E-04 11 3.6795374E+04 9.2597726E-03 -5.2426964E-03 2.9155816E-03 -1.5660962E-03 7.2471339E-04 -2.1389829E-04 12 1.8406518E+04 1.7715435E-02 -1.0123033E-02 5.6388630E-03 -3.0264144E-03 1.3985756E-03 -4.1263962E-04 13 9.3577219E+03 3.4463614E-02 -1.9946613E-02 1.1155681E-02 -6.0018280E-03 2.7783340E-03 -8.2006631E-04 14 4.8469532E+03 6.6735767E-02 -3.9270614E-02 2.2046697E-02 -1.1860376E-02 5.4846537E-03 -1.6183985E-03 15 2.5640376E+03 1.2339658E-01 -7.4229145E-02 4.1954514E-02 -2.2644113E-02 1.0491698E-02 -3.0972585E-03 16 1.3868465E+03 2.0457301E-01 -1.2625779E-01 7.1826651E-02 -3.8784232E-02 1.7950158E-02 -5.2973329E-03 17 7.6774319E+02 2.7772745E-01 -1.7363023E-01 9.9221690E-02 -5.3767307E-02 2.4953198E-02 -7.3690112E-03 18 4.3488315E+02 2.7174547E-01 -1.4383940E-01 7.5490369E-02 -3.9458286E-02 1.8041798E-02 -5.3114693E-03 19 2.5133617E+02 1.6303034E-01 4.3911230E-02 -6.2071690E-02 3.9994878E-02 -1.9244516E-02 5.7128161E-03 20 1.4826094E+02 4.7004344E-02 3.3110884E-01 -3.0630447E-01 1.9127991E-01 -9.2446847E-02 2.7496116E-02 21 8.8947607E+01 4.8924786E-03 4.3574640E-01 -4.0448615E-01 2.4743474E-01 -1.1779039E-01 3.4909906E-02 22 5.3289873E+01 -3.7260421E-05 2.5140238E-01 -6.8197238E-02 4.6841359E-03 1.3951038E-03 -5.6252201E-04 23 3.1997441E+01 -2.5520822E-05 5.3687028E-02 4.7511736E-01 -4.8259798E-01 2.6860887E-01 -8.1890276E-02 24 1.9489552E+01 -9.4880619E-05 3.8428388E-03 5.3960950E-01 -5.8131192E-01 3.1767714E-01 -9.6229512E-02 25 1.1674663E+01 5.3324760E-05 -4.0198346E-04 1.9885733E-01 1.3444083E-01 -1.4797345E-01 4.8820136E-02 26 6.8825431E+00 -2.4293699E-05 9.1612094E-05 1.9778129E-02 6.8548810E-01 -5.8472095E-01 1.9225879E-01 27 4.0384544E+00 2.3702111E-05 -2.0985811E-04 1.6967433E-03 4.2820124E-01 -3.4769781E-01 1.1321297E-01 28 2.3349338E+00 -1.4429057E-05 1.2205159E-04 -5.9918411E-04 8.1966845E-02 3.3713460E-01 -1.4827196E-01 29 1.3354373E+00 8.4645037E-06 -7.2193488E-05 2.8567437E-04 4.9956165E-03 5.8708809E-01 -2.6853786E-01 30 7.6046347E-01 -5.6434122E-06 4.9204742E-05 -2.1867158E-04 1.7097336E-05 3.3001512E-01 -1.5852405E-01 31 4.3020400E-01 2.8972708E-06 -2.5626328E-05 1.1213169E-04 1.1181367E-05 8.0878203E-02 7.8357551E-02 32 2.2986305E-01 -1.3833597E-06 1.2179941E-05 -5.1829181E-05 -9.8305021E-05 9.6587460E-03 3.2891595E-01 33 1.1658824E-01 5.9896084E-07 -5.3272018E-06 2.3524999E-05 1.2843558E-05 9.3659063E-04 4.4510676E-01 34 5.6626962E-02 -2.2009246E-07 1.9560093E-06 -8.3107865E-06 -1.5983651E-05 3.5256720E-04 2.9675752E-01 35 2.6358431E-02 5.6297623E-08 -5.0257364E-07 2.2196526E-06 1.7004297E-06 3.0760957E-05 5.1030153E-02 3d 4d 5d 6d 1 1.2616748E+06 2.8683035E-06 -1.7420536E-06 9.0697896E-07 -3.4126544E-07 2 2.8662303E+05 1.4506708E-05 -8.8447695E-06 4.6184807E-06 -1.7407310E-06 3 8.7855770E+04 6.0531364E-05 -3.6923604E-05 1.9257788E-05 -7.2509022E-06 4 3.1791722E+04 2.2780240E-04 -1.3945199E-04 7.2857438E-05 -2.7457037E-05 5 1.2905853E+04 8.1022911E-04 -4.9755016E-04 2.6008102E-04 -9.7993872E-05 6 5.7257848E+03 2.7722088E-03 -1.7094235E-03 8.9455738E-04 -3.3719662E-04 7 2.7318216E+03 8.9690574E-03 -5.5665811E-03 2.9189466E-03 -1.1007108E-03 8 1.3816948E+03 2.6499020E-02 -1.6570919E-02 8.7040844E-03 -3.2835033E-03 9 7.3169894E+02 6.8962686E-02 -4.3743999E-02 2.3080949E-02 -8.7163198E-03 10 4.0235578E+02 1.5068989E-01 -9.6653208E-02 5.1113755E-02 -1.9310659E-02 11 2.2748096E+02 2.5862483E-01 -1.6480742E-01 8.7115878E-02 -3.2915153E-02 12 1.3150853E+02 3.2096986E-01 -1.8620990E-01 9.4767673E-02 -3.5449270E-02 13 7.7038004E+01 2.5124759E-01 -4.2419794E-02 -1.6894233E-03 2.8484306E-03 14 4.5388023E+01 1.0690733E-01 2.4652548E-01 -1.9317677E-01 7.9034058E-02 15 2.6994011E+01 1.8549775E-02 4.4293249E-01 -3.3389442E-01 1.3592390E-01 16 1.6114236E+01 1.2463641E-03 3.1847616E-01 -1.1810619E-01 3.1079780E-02 17 9.5457064E+00 -2.2276374E-04 9.8553031E-02 3.2534503E-01 -1.8078123E-01 18 5.5737719E+00 5.9797829E-07 1.0235201E-02 5.0390209E-01 -2.7403266E-01 19 3.2100412E+00 -7.5057158E-05 6.2438388E-04 2.9092059E-01 -7.2152503E-02 20 1.7999468E+00 2.2311912E-05 -7.1084239E-05 6.7067502E-02 2.7114031E-01 21 9.7727630E-01 -1.3862287E-05 3.2070302E-05 4.6233140E-03 4.4014519E-01 22 5.1139672E-01 6.1030235E-06 -1.8586265E-05 3.2416138E-04 3.4181967E-01 23 2.5468564E-01 -2.3503695E-06 8.1761941E-06 -8.9639332E-05 1.3761185E-01 24 1.1303759E-01 5.4948437E-07 -1.3138763E-06 -2.3326010E-06 1.8672098E-02 4f 5f 1 7.2916097E+03 5.2438448E-05 -2.6175296E-05 2 2.3263015E+03 4.7563644E-04 -2.4000757E-04 3 9.6023538E+02 2.9315211E-03 -1.4742215E-03 4 4.5183580E+02 1.3650689E-02 -6.9248309E-03 5 2.3099948E+02 4.7279766E-02 -2.3962400E-02 6 1.2410346E+02 1.2414335E-01 -6.3528323E-02 7 6.9117564E+01 2.4011249E-01 -1.1933467E-01 8 3.9140259E+01 3.3129376E-01 -1.5090092E-01 9 2.2462698E+01 3.0059979E-01 -7.6477932E-02 10 1.2874500E+01 1.5613645E-01 1.4962323E-01 11 7.2447405E+00 3.7670411E-02 3.6473704E-01 12 4.0088311E+00 2.4831232E-03 3.8379314E-01 13 2.1533604E+00 1.4340398E-04 2.2156990E-01 14 1.0944519E+00 -8.2833882E-05 6.2584767E-02 15 4.8241565E-01 9.6345577E-06 5.1848106E-03 16 1.7263001E-01 -4.4650406E-06 2.1389250E-05 ** Uuh 293 ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2379926E+07 2.0165593E-03 -9.6447577E-04 4.8092413E-04 2.6007154E-04 -1.4215424E-04 7.2802248E-05 -2.9947020E-05 2 1.3924329E+07 4.4138778E-03 -2.1254679E-03 1.0611975E-03 5.7406156E-04 -3.1381233E-04 1.6071928E-04 -6.6111951E-05 3 4.7322187E+06 7.9044528E-03 -3.8355316E-03 1.9177374E-03 1.0378016E-03 -5.6738011E-04 2.9059410E-04 -1.1953685E-04 4 1.7765482E+06 1.2774533E-02 -6.2720560E-03 3.1428171E-03 1.7017336E-03 -9.3052373E-04 4.7660880E-04 -1.9605713E-04 5 7.3036170E+05 2.0131753E-02 -1.0018639E-02 5.0325647E-03 2.7267236E-03 -1.4912777E-03 7.6386814E-04 -3.1422720E-04 6 3.1755048E+05 3.0723056E-02 -1.5570691E-02 7.8470933E-03 4.2552992E-03 -2.3278940E-03 1.1924921E-03 -4.9055754E-04 7 1.4562739E+05 4.6355988E-02 -2.3965717E-02 1.2120581E-02 6.5787267E-03 -3.5998698E-03 1.8442316E-03 -7.5867425E-04 8 6.9505217E+04 6.8472787E-02 -3.6243432E-02 1.8405674E-02 1.0000801E-02 -5.4743543E-03 2.8047964E-03 -1.1538658E-03 9 3.4513516E+04 9.8443592E-02 -5.3344591E-02 2.7203213E-02 1.4796942E-02 -8.1019045E-03 4.1514554E-03 -1.7078730E-03 10 1.7739932E+04 1.3477014E-01 -7.4797752E-02 3.8302835E-02 2.0857149E-02 -1.1425055E-02 5.8547442E-03 -2.4087333E-03 11 9.4501659E+03 1.6943495E-01 -9.5424680E-02 4.8957082E-02 2.6669496E-02 -1.4607229E-02 7.4859035E-03 -3.0795950E-03 12 5.2204463E+03 1.8461659E-01 -1.0183111E-01 5.1657042E-02 2.8039868E-02 -1.5350075E-02 7.8632912E-03 -3.2353031E-03 13 3.0177305E+03 1.6021226E-01 -7.1259074E-02 3.2439038E-02 1.6962323E-02 -9.1441185E-03 4.6685012E-03 -1.9170807E-03 14 1.8496131E+03 1.0180268E-01 1.1136927E-03 -1.4634229E-02 -1.0445739E-02 6.0717912E-03 -3.1835251E-03 1.3099882E-03 15 1.2410420E+03 4.5957942E-02 8.2489787E-02 -7.1656367E-02 -4.4528431E-02 2.5589077E-02 -1.3254822E-02 5.4831008E-03 16 8.5987447E+02 2.2077979E-02 1.7981425E-01 -1.5810332E-01 -9.9321341E-02 5.6439517E-02 -2.9318410E-02 1.2070853E-02 17 5.7548802E+02 4.3438138E-03 2.9586271E-01 -2.8258419E-01 -1.8317099E-01 1.0636398E-01 -5.5357342E-02 2.2893832E-02 18 3.7079951E+02 8.9820038E-04 3.0810731E-01 -3.3206699E-01 -2.2244393E-01 1.2911888E-01 -6.7461782E-02 2.7825275E-02 19 2.3442462E+02 -3.2426696E-04 1.7674830E-01 -1.1128508E-01 -6.0510781E-02 3.4885038E-02 -1.8012483E-02 7.5012104E-03 20 1.4620622E+02 2.5212578E-04 4.3061118E-02 3.5265715E-01 3.9975525E-01 -2.7761021E-01 1.5247354E-01 -6.3874039E-02 21 9.4492348E+01 -2.8209917E-04 2.6693752E-03 5.3675974E-01 7.2575514E-01 -5.2527241E-01 2.9279339E-01 -1.2252005E-01 22 6.2359752E+01 2.5037860E-04 7.0493465E-04 3.4447596E-01 4.5741045E-01 -3.3130675E-01 1.8478102E-01 -7.8019841E-02 23 4.0663476E+01 -2.4636639E-04 -3.8116638E-04 1.0835514E-01 -1.2396819E-01 1.4616792E-01 -7.8038989E-02 3.2902017E-02 24 2.9045340E+01 2.0381431E-04 1.2445790E-04 6.1947453E-03 -6.6847028E-01 8.9698269E-01 -6.3530663E-01 2.8115734E-01 25 1.9196278E+01 -1.0802873E-04 -1.1685788E-04 5.0356931E-03 -6.2451805E-01 1.0246891E+00 -7.2290208E-01 3.1947136E-01 26 1.2128714E+01 5.9623771E-05 4.5414263E-05 -1.5851950E-03 -1.7973376E-01 -1.3256711E-01 2.1733644E-01 -1.0565055E-01 27 7.5552708E+00 -3.7273467E-05 -1.1397755E-05 7.1364575E-04 -1.1031762E-02 -9.5875125E-01 1.1392327E+00 -5.7280830E-01 28 4.7621210E+00 2.3715499E-05 1.5967726E-05 -5.7202203E-04 -1.9530078E-03 -5.4082398E-01 8.1178904E-01 -4.5852502E-01 29 3.0890304E+00 -1.3316142E-05 -7.1077155E-06 2.8656301E-04 4.5448965E-04 -1.1237064E-01 -2.5411173E-01 2.0668860E-01 30 1.8607094E+00 5.7034817E-06 2.0567042E-06 -1.1341860E-04 -1.5473972E-04 -8.4990789E-03 -8.9486398E-01 7.5094393E-01 31 1.0735002E+00 -2.2156925E-06 -1.4341368E-06 5.1068968E-05 1.0317763E-04 3.3635683E-04 -5.3227013E-01 5.7696157E-01 32 5.6343614E-01 8.5602630E-07 3.7857793E-07 -1.7725639E-05 -2.2544988E-05 -8.2037171E-05 -7.1564374E-02 -2.5029105E-01 33 2.9974166E-01 -3.4877714E-07 -1.5060544E-07 7.2676299E-06 9.9635867E-06 3.0560798E-05 2.8415165E-04 -7.0431109E-01 34 1.4931976E-01 1.0625662E-07 6.1182869E-08 -2.3659494E-06 -3.8255861E-06 -5.3657314E-06 -3.5910425E-04 -4.4534869E-01 35 6.5359317E-02 -1.9810302E-08 -6.9916218E-09 3.9789405E-07 4.5104130E-07 1.3579298E-06 1.3408083E-04 -6.2103562E-02 2p 3p 4p 5p 6p 7p 1 8.9528327E+07 6.6453046E-06 -3.6728007E-06 2.0310352E-06 -1.0922967E-06 5.1180668E-07 -1.6187967E-07 2 3.9254436E+07 3.2282510E-05 -1.7831672E-05 9.8581639E-06 -5.3003884E-06 2.4830437E-06 -7.8532924E-07 3 1.6889040E+07 7.3658708E-05 -4.0698353E-05 2.2503626E-05 -1.2101665E-05 5.6700774E-06 -1.7933737E-06 4 7.4319801E+06 1.4086168E-04 -7.7863983E-05 4.3055105E-05 -2.3150443E-05 1.0845283E-05 -3.4301183E-06 5 3.3430260E+06 2.5196652E-04 -1.3938697E-04 7.7098008E-05 -4.1465458E-05 1.9428980E-05 -6.1451942E-06 6 1.5331357E+06 4.3951293E-04 -2.4340633E-04 1.3465742E-04 -7.2412782E-05 3.3923574E-05 -1.0729271E-05 7 7.1481868E+05 7.6044481E-04 -4.2187222E-04 2.3352961E-04 -1.2563282E-04 5.8872427E-05 -1.8621143E-05 8 3.3842964E+05 1.3205098E-03 -7.3444378E-04 4.0676012E-04 -2.1879784E-04 1.0250503E-04 -3.2420204E-05 9 1.6259215E+05 2.3245735E-03 -1.2978376E-03 7.1967671E-04 -3.8739379E-04 1.8157411E-04 -5.7433602E-05 10 7.9242618E+04 4.1905192E-03 -2.3522712E-03 1.3059033E-03 -7.0289177E-04 3.2933533E-04 -1.0416362E-04 11 3.9170466E+04 7.8022346E-03 -4.4125615E-03 2.4554042E-03 -1.3232115E-03 6.2043678E-04 -1.9626427E-04 12 1.9647657E+04 1.5027521E-02 -8.5819418E-03 4.7859674E-03 -2.5791822E-03 1.2087736E-03 -3.8233254E-04 13 1.0020777E+04 2.9623989E-02 -1.7132634E-02 9.5913505E-03 -5.1786158E-03 2.4296710E-03 -7.6867139E-04 14 5.2109283E+03 5.8323031E-02 -3.4280403E-02 1.9264692E-02 -1.0404131E-02 4.8784580E-03 -1.5431745E-03 15 2.7675752E+03 1.1006745E-01 -6.6058461E-02 3.7362404E-02 -2.0238368E-02 9.5050979E-03 -3.0076903E-03 16 1.5014692E+03 1.8760676E-01 -1.1536087E-01 6.5638438E-02 -3.5569333E-02 1.6690112E-02 -5.2800922E-03 17 8.3196656E+02 2.6536742E-01 -1.6563369E-01 9.4746926E-02 -5.1532153E-02 2.4242171E-02 -7.6733794E-03 18 4.7044328E+02 2.7505510E-01 -1.5109378E-01 8.1000599E-02 -4.2841049E-02 1.9918228E-02 -6.2900879E-03 19 2.7074129E+02 1.7734681E-01 1.8073531E-02 -4.2835849E-02 2.8893435E-02 -1.4214059E-02 4.5327260E-03 20 1.5872313E+02 5.5918859E-02 3.0743127E-01 -2.8488466E-01 1.7846672E-01 -8.7454391E-02 2.7887577E-02 21 9.4890277E+01 6.3639366E-03 4.3996603E-01 -4.1176190E-01 2.5431329E-01 -1.2306305E-01 3.9136429E-02 22 5.6801830E+01 1.4120269E-04 2.7116580E-01 -1.0878928E-01 3.4567648E-02 -1.3655140E-02 4.1885691E-03 23 3.4091498E+01 -6.9335760E-05 6.3737068E-02 4.3958480E-01 -4.4707155E-01 2.5214802E-01 -8.2491669E-02 24 2.0835533E+01 -6.3203610E-05 4.6840799E-03 5.5533624E-01 -6.0739527E-01 3.4006422E-01 -1.1086736E-01 25 1.2557672E+01 3.4008313E-05 -1.9081373E-04 2.2519118E-01 6.0446238E-02 -1.0029053E-01 3.6683789E-02 26 7.4761806E+00 -1.2149632E-05 5.2354171E-06 2.6418025E-02 6.5849661E-01 -5.6727444E-01 2.0044917E-01 27 4.4604272E+00 1.8181042E-05 -1.7931326E-04 2.0518431E-03 4.6942326E-01 -4.1272054E-01 1.4729418E-01 28 2.6411534E+00 -1.0861901E-05 1.0260533E-04 -5.7775733E-04 1.1076773E-01 2.4073113E-01 -1.1957027E-01 29 1.5537526E+00 6.1852410E-06 -5.9462670E-05 2.7420082E-04 8.5821546E-03 5.8066146E-01 -2.8475906E-01 30 9.0207730E-01 -4.0251204E-06 3.9811794E-05 -2.0862558E-04 3.7026197E-04 3.9672194E-01 -2.1563659E-01 31 5.0791756E-01 1.7886948E-06 -1.8097368E-05 9.3417470E-05 -1.0123765E-04 1.1206833E-01 5.8516320E-02 32 2.6603230E-01 -8.1727711E-07 8.2133697E-06 -4.0108811E-05 -6.4824318E-05 1.2342842E-02 3.6036226E-01 33 1.3325972E-01 3.6335881E-07 -3.6828956E-06 1.9221704E-05 -1.5905172E-05 1.3492841E-03 4.6219998E-01 34 6.4549101E-02 -1.3046188E-07 1.3367720E-06 -6.5045821E-06 -1.0455695E-05 4.2632460E-04 2.7781153E-01 35 3.0167973E-02 3.5604903E-08 -3.6155476E-07 1.8714652E-06 -7.1927406E-07 4.9593534E-05 4.2125871E-02 3d 4d 5d 6d 1 1.3935969E+06 2.5002533E-06 -1.5285999E-06 8.0234238E-07 -3.1190932E-07 2 3.1789037E+05 1.2079837E-05 -7.3886367E-06 3.8785018E-06 -1.5079188E-06 3 9.7293283E+04 4.8795902E-05 -2.9899833E-05 1.5704023E-05 -6.1056683E-06 4 3.5121936E+04 1.8098355E-04 -1.1108811E-04 5.8368878E-05 -2.2698636E-05 5 1.4225588E+04 6.4916383E-04 -3.9994680E-04 2.1037790E-04 -8.1821672E-05 6 6.2939990E+03 2.2692102E-03 -1.4030729E-03 7.3870020E-04 -2.8740264E-04 7 2.9922028E+03 7.5381654E-03 -4.6901338E-03 2.4738172E-03 -9.6274496E-04 8 1.5082068E+03 2.2862974E-02 -1.4327561E-02 7.5714831E-03 -2.9483354E-03 9 7.9626924E+02 6.1107557E-02 -3.8800754E-02 2.0583424E-02 -8.0212574E-03 10 4.3664660E+02 1.3767496E-01 -8.8483344E-02 4.7085315E-02 -1.8364431E-02 11 2.4637439E+02 2.4473013E-01 -1.5661970E-01 8.3282650E-02 -3.2472498E-02 12 1.4220393E+02 3.1771727E-01 -1.8887871E-01 9.7712632E-02 -3.7838976E-02 13 8.3336868E+01 2.6346192E-01 -6.7405366E-02 1.4641212E-02 -3.6224786E-03 14 4.9198353E+01 1.2176760E-01 2.1282846E-01 -1.7138338E-01 7.2607031E-02 15 2.9229199E+01 2.4190143E-02 4.3641190E-01 -3.3374536E-01 1.4098679E-01 16 1.7476321E+01 1.5708375E-03 3.4234947E-01 -1.6085762E-01 5.2566258E-02 17 1.0394349E+01 -1.0445149E-04 1.1724175E-01 2.8499950E-01 -1.6742665E-01 18 6.0764938E+00 -6.5316451E-05 1.4146466E-02 5.1055460E-01 -2.9006423E-01 19 3.5085826E+00 -4.6083718E-05 6.6353243E-04 3.1941821E-01 -1.0474099E-01 20 1.9769630E+00 4.6716708E-06 -1.0128561E-05 7.9673821E-02 2.5758076E-01 21 1.0814289E+00 -5.5241098E-06 6.1069273E-06 5.9398145E-03 4.5095243E-01 22 5.7122110E-01 2.2900723E-06 -7.0738436E-06 3.3426259E-04 3.5052258E-01 23 2.8647155E-01 -9.5854884E-07 4.8655324E-06 -1.1242375E-04 1.3741861E-01 24 1.2659727E-01 1.8698061E-07 -1.2318100E-07 -8.4161651E-06 1.8004799E-02 4f 5f 1 7.5696613E+03 4.6348421E-05 -2.3492547E-05 2 2.4109604E+03 4.3829818E-04 -2.2414352E-04 3 9.9391221E+02 2.7689860E-03 -1.4119419E-03 4 4.6727769E+02 1.3094557E-02 -6.7340853E-03 5 2.3879068E+02 4.5896598E-02 -2.3582660E-02 6 1.2828739E+02 1.2162311E-01 -6.3096923E-02 7 7.1474419E+01 2.3724106E-01 -1.1962625E-01 8 4.0508322E+01 3.2982217E-01 -1.5259532E-01 9 2.3278551E+01 3.0160050E-01 -7.9242652E-02 10 1.3373065E+01 1.5815663E-01 1.4764961E-01 11 7.5576700E+00 3.8818605E-02 3.6388268E-01 12 4.2169552E+00 2.6747234E-03 3.8164164E-01 13 2.2998596E+00 1.6009224E-04 2.2055757E-01 14 1.1952368E+00 -8.8537789E-05 6.3921512E-02 15 5.3507461E-01 1.0640779E-05 5.4647299E-03 16 2.0355074E-01 -4.9531074E-06 -1.8764266E-05 Pseudo-large component functions -------------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2379926E+07 4.0342991E-05 -1.9218515E-05 9.5758742E-06 5.1773664E-06 -2.8297576E-06 1.4491943E-06 -5.9611965E-07 2 1.3924329E+07 2.4908670E-04 -1.1868640E-04 5.9139708E-05 3.1975330E-05 -1.7476683E-05 8.9502804E-06 -3.6816649E-06 3 4.7322187E+06 7.4934325E-04 -3.5758463E-04 1.7823203E-04 9.6373021E-05 -5.2675279E-05 2.6976640E-05 -1.1096735E-05 4 1.7765482E+06 2.0217835E-03 -9.6609724E-04 4.8166858E-04 2.6046572E-04 -1.4236924E-04 7.2912096E-05 -2.9992252E-05 5 7.3036170E+05 4.6805286E-03 -2.2409014E-03 1.1177279E-03 6.0448834E-04 -3.3041675E-04 1.6921964E-04 -6.9607981E-05 6 3.1755048E+05 1.0323385E-02 -4.9535875E-03 2.4720817E-03 1.3371443E-03 -7.3093966E-04 3.7434739E-04 -1.5398831E-04 7 1.4562739E+05 2.0865460E-02 -1.0045621E-02 5.0176514E-03 2.7146890E-03 -1.4840234E-03 7.6005551E-04 -3.1264785E-04 8 6.9505217E+04 4.0104748E-02 -1.9399083E-02 9.7022916E-03 5.2511543E-03 -2.8710888E-03 1.4704938E-03 -6.0490088E-04 9 3.4513516E+04 7.0667381E-02 -3.4426093E-02 1.7255456E-02 9.3447965E-03 -5.1098474E-03 2.6172958E-03 -1.0766324E-03 10 1.7739932E+04 1.1481585E-01 -5.6457383E-02 2.8383936E-02 1.5384766E-02 -8.4159503E-03 4.3109719E-03 -1.7734461E-03 11 9.4501659E+03 1.6298320E-01 -8.0736313E-02 4.0715120E-02 2.2086913E-02 -1.2082061E-02 6.1895608E-03 -2.5460688E-03 12 5.2204463E+03 1.9608959E-01 -9.5237400E-02 4.7761819E-02 2.5865281E-02 -1.4150738E-02 7.2475548E-03 -2.9818502E-03 13 3.0177305E+03 1.7910267E-01 -7.2586223E-02 3.3765739E-02 1.7829441E-02 -9.6462770E-03 4.9299174E-03 -2.0250895E-03 14 1.8496131E+03 1.2252792E-01 -7.2034195E-03 -7.8784201E-03 -6.2821434E-03 3.7062585E-03 -1.9576617E-03 8.0455842E-04 15 1.2410420E+03 5.0147517E-02 7.7776258E-02 -6.5113702E-02 -4.0168395E-02 2.3054465E-02 -1.1933889E-02 4.9371987E-03 16 8.5987447E+02 3.2937660E-02 1.7276800E-01 -1.4830834E-01 -9.2641222E-02 5.2533623E-02 -2.7276940E-02 1.1227710E-02 17 5.7548802E+02 1.6394857E-05 2.9949970E-01 -2.7726601E-01 -1.7866145E-01 1.0358683E-01 -5.3886528E-02 2.2283659E-02 18 3.7079951E+02 5.6309201E-03 3.1312990E-01 -3.3085511E-01 -2.2107523E-01 1.2823742E-01 -6.6988338E-02 2.7629001E-02 19 2.3442462E+02 -4.5460097E-03 1.8422144E-01 -1.1772943E-01 -6.6315112E-02 3.8592547E-02 -2.0001154E-02 8.3273009E-03 20 1.4620622E+02 4.7940273E-03 4.2904560E-02 3.4984303E-01 3.9293243E-01 -2.7222975E-01 1.4941061E-01 -6.2582640E-02 21 9.4492348E+01 -5.7022472E-03 4.9382175E-03 5.3818046E-01 7.2361850E-01 -5.2314825E-01 2.9154110E-01 -1.2199050E-01 22 6.2359752E+01 6.4178712E-03 -1.7457539E-03 3.4817915E-01 4.5988240E-01 -3.3318556E-01 1.8581692E-01 -7.8449849E-02 23 4.0663476E+01 -7.6492934E-03 2.5822863E-03 1.0826521E-01 -1.2199231E-01 1.4324575E-01 -7.6070317E-02 3.2036363E-02 24 2.9045340E+01 7.1873969E-03 -2.6807351E-03 7.3723703E-03 -6.6836578E-01 8.9516415E-01 -6.3367539E-01 2.8040560E-01 25 1.9196278E+01 -4.7321561E-03 1.7441766E-03 4.3367861E-03 -6.2616357E-01 1.0255659E+00 -7.2346060E-01 3.1971681E-01 26 1.2128714E+01 3.2270669E-03 -1.2314618E-03 -1.0862235E-03 -1.8010770E-01 -1.3158422E-01 2.1611437E-01 -1.0504836E-01 27 7.5552708E+00 -2.4928422E-03 9.8017736E-04 3.1995925E-04 -1.1202049E-02 -9.5895571E-01 1.1388287E+00 -5.7252856E-01 28 4.7621210E+00 2.0368928E-03 -7.9767068E-04 -2.4698755E-04 -1.8424253E-03 -5.4127676E-01 8.1207508E-01 -4.5866188E-01 29 3.0890304E+00 -1.4200223E-03 5.6185156E-04 5.8050112E-05 3.7402816E-04 -1.1243029E-01 -2.5396147E-01 2.0652379E-01 30 1.8607094E+00 7.8580842E-04 -3.1370450E-04 1.4001451E-05 -1.0927208E-04 -8.5259600E-03 -8.9492226E-01 7.5088782E-01 31 1.0735002E+00 -4.1667381E-04 1.6641550E-04 -1.6858413E-05 7.8825123E-05 3.4715781E-04 -5.3236344E-01 5.7699679E-01 32 5.6343614E-01 2.2748659E-04 -9.1450331E-05 1.9545215E-05 -9.1074959E-06 -8.7829006E-05 -7.1572363E-02 -2.5027656E-01 33 2.9974166E-01 -1.3307353E-04 5.3648782E-05 -1.4608692E-05 2.0597651E-06 3.3930183E-05 2.8203463E-04 -7.0431883E-01 34 1.4931976E-01 6.2538393E-05 -2.5252003E-05 7.9413021E-06 -9.9034184E-08 -6.9435755E-06 -3.5809969E-04 -4.4535672E-01 35 6.5359317E-02 -1.9980529E-05 8.0881267E-06 -2.9020896E-06 -7.4321349E-07 1.8615435E-06 1.3375173E-04 -6.2104545E-02 2p 3p 4p 5p 6p 7p 1 8.9528327E+07 4.3671995E-08 -2.4155090E-08 1.3372633E-08 -7.2048465E-09 3.3813159E-09 -1.0698462E-09 2 3.9254436E+07 3.1838731E-07 -1.7615846E-07 9.7374872E-08 -5.2304915E-08 2.4479646E-08 -7.7407464E-09 3 1.6889040E+07 1.1710762E-06 -6.4853085E-07 3.5899107E-07 -1.9326882E-07 9.0635346E-08 -2.8672326E-08 4 7.4319801E+06 3.5081682E-06 -1.9446414E-06 1.0755695E-06 -5.7793124E-07 2.7053782E-07 -8.5550843E-08 5 3.3430260E+06 9.6787185E-06 -5.3744292E-06 2.9770247E-06 -1.6029957E-06 7.5175424E-07 -2.3781650E-07 6 1.5331357E+06 2.5721454E-05 -1.4309631E-05 7.9221674E-06 -4.2580598E-06 1.9934466E-06 -6.3038889E-07 7 7.1481868E+05 6.7263836E-05 -3.7524097E-05 2.0810361E-05 -1.1209127E-05 5.2570984E-06 -1.6630959E-06 8 3.3842964E+05 1.7475938E-04 -9.7781259E-05 5.4216391E-05 -2.9155006E-05 1.3651495E-05 -4.3171609E-06 9 1.6259215E+05 4.5328688E-04 -2.5459807E-04 1.4144089E-04 -7.6218406E-05 3.5749137E-05 -1.1309445E-05 10 7.9242618E+04 1.1743511E-03 -6.6233380E-04 3.6802465E-04 -1.9804724E-04 9.2757331E-05 -2.9335120E-05 11 3.9170466E+04 3.0286232E-03 -1.7171386E-03 9.5624615E-04 -5.1561432E-04 2.4186678E-04 -7.6517121E-05 12 1.9647657E+04 7.6955094E-03 -4.3909751E-03 2.4474818E-03 -1.3184041E-03 6.1769573E-04 -1.9536280E-04 13 1.0020777E+04 1.8915131E-02 -1.0891872E-02 6.0907298E-03 -3.2880616E-03 1.5428279E-03 -4.8811455E-04 14 5.2109283E+03 4.3877135E-02 -2.5600840E-02 1.4357154E-02 -7.7479775E-03 3.6318868E-03 -1.1487848E-03 15 2.7675752E+03 9.2842179E-02 -5.5229617E-02 3.1167841E-02 -1.6873491E-02 7.9240984E-03 -2.5073879E-03 16 1.5014692E+03 1.7058621E-01 -1.0398170E-01 5.9033852E-02 -3.1967843E-02 1.4996525E-02 -4.7440871E-03 17 8.3196656E+02 2.5282972E-01 -1.5685174E-01 8.9632525E-02 -4.8741060E-02 2.2928938E-02 -7.2577073E-03 18 4.7044328E+02 2.6862762E-01 -1.4798714E-01 7.9669221E-02 -4.2207912E-02 1.9633672E-02 -6.2007911E-03 19 2.7074129E+02 1.7338720E-01 1.6138464E-02 -4.0142144E-02 2.7122644E-02 -1.3340765E-02 4.2540019E-03 20 1.5872313E+02 5.1197437E-02 3.0518351E-01 -2.8107507E-01 1.7583422E-01 -8.6136204E-02 2.7465729E-02 21 9.4890277E+01 1.1952081E-03 4.4088111E-01 -4.1107984E-01 2.5379061E-01 -1.2280368E-01 3.9053649E-02 22 5.6801830E+01 -4.5801354E-03 2.7261374E-01 -1.1079812E-01 3.6288362E-02 -1.4565579E-02 4.4828697E-03 23 3.4091498E+01 -4.1563820E-03 6.4255537E-02 4.3787784E-01 -4.4496231E-01 2.5090092E-01 -8.2080609E-02 24 2.0835533E+01 -3.5655057E-03 4.6692160E-03 5.5532711E-01 -6.0714444E-01 3.3994590E-01 -1.1083088E-01 25 1.2557672E+01 -3.2954493E-03 -1.4721086E-04 2.2492357E-01 6.0016999E-02 -9.9820486E-02 3.6515015E-02 26 7.4761806E+00 -2.8099403E-03 -3.0367790E-05 2.5968421E-02 6.5852554E-01 -5.6704269E-01 2.0035383E-01 27 4.4604272E+00 -2.6315987E-03 -1.4608801E-04 1.4960181E-03 4.6970692E-01 -4.1287108E-01 1.4734802E-01 28 2.6411534E+00 -2.1128981E-03 7.6750667E-05 -9.6155279E-04 1.1085441E-01 2.4058788E-01 -1.1949859E-01 29 1.5537526E+00 -2.2366157E-03 -3.6549389E-05 -1.9163409E-04 8.6480377E-03 5.8058923E-01 -2.8471768E-01 30 9.0207730E-01 -1.5062908E-03 2.4613212E-05 -4.8671088E-04 3.9214497E-04 3.9670203E-01 -2.1562658E-01 31 5.0791756E-01 -2.1167068E-03 -6.4886733E-06 -3.3536548E-04 -4.9692185E-05 1.1199883E-01 5.8527990E-02 32 2.6603230E-01 -1.1218101E-03 2.3323469E-06 -2.5367579E-04 -4.5059302E-05 1.2304498E-02 3.6036834E-01 33 1.3325972E-01 -2.1866859E-03 1.5421694E-06 -4.1594760E-04 3.3058490E-05 1.2690837E-03 4.6221831E-01 34 6.4549101E-02 -1.3982591E-04 -9.7892013E-07 -3.1364043E-05 -8.9634810E-06 4.2181035E-04 2.7781375E-01 35 3.0167973E-02 -2.5383364E-03 1.9501932E-06 -4.9904524E-04 5.3783085E-05 -4.2667979E-05 4.2146261E-02 3d 4d 5d 6d 1 1.3935969E+06 9.7436827E-08 -5.9737777E-08 3.1384383E-08 -1.2198489E-08 2 3.1789037E+05 1.1364137E-06 -6.9580171E-07 3.6530650E-07 -1.4207503E-07 3 9.7293283E+04 9.1009900E-06 -5.5920681E-06 2.9394831E-06 -1.1428481E-06 4 3.5121936E+04 5.8516150E-05 -3.5955896E-05 1.8896976E-05 -7.3500284E-06 5 1.4225588E+04 3.1636471E-04 -1.9500799E-04 1.0259150E-04 -3.9899083E-05 6 6.2939990E+03 1.4656507E-03 -9.0528374E-04 4.7648011E-04 -1.8537648E-04 7 2.9922028E+03 5.8280776E-03 -3.6195930E-03 1.9081939E-03 -7.4251606E-04 8 1.5082068E+03 1.9723105E-02 -1.2331272E-02 6.5124448E-03 -2.5356121E-03 9 7.9626924E+02 5.6251296E-02 -3.5630882E-02 1.8889258E-02 -7.3598602E-03 10 4.3664660E+02 1.3167237E-01 -8.4457780E-02 4.4920661E-02 -1.7518293E-02 11 2.4637439E+02 2.3920325E-01 -1.5289273E-01 8.1276305E-02 -3.1687903E-02 12 1.4220393E+02 3.1442544E-01 -1.8700571E-01 9.6795527E-02 -3.7490096E-02 13 8.3336868E+01 2.6224010E-01 -6.7876817E-02 1.5214644E-02 -3.8781174E-03 14 4.9198353E+01 1.2108810E-01 2.1146600E-01 -1.7018440E-01 7.2088593E-02 15 2.9229199E+01 2.3541016E-02 4.3567407E-01 -3.3301628E-01 1.4067239E-01 16 1.7476321E+01 1.0250024E-03 3.4232619E-01 -1.6112310E-01 5.2735400E-02 17 1.0394349E+01 -4.7091829E-04 1.1714324E-01 2.8460163E-01 -1.6717182E-01 18 6.0764938E+00 -3.3364777E-04 1.4020111E-02 5.1038766E-01 -2.8994096E-01 19 3.5085826E+00 -2.1493686E-04 5.4081844E-04 3.1940542E-01 -1.0478125E-01 20 1.9769630E+00 -1.2313948E-04 -7.9439149E-05 7.9616786E-02 2.5753143E-01 21 1.0814289E+00 -7.9848794E-05 -4.8982359E-05 5.9028528E-03 4.5092608E-01 22 5.7122110E-01 -5.8102111E-05 -4.0372586E-05 2.9631122E-04 3.5051655E-01 23 2.8647155E-01 -2.8348892E-05 -1.5183523E-05 -1.2684451E-04 1.3741407E-01 24 1.2659727E-01 -3.3850729E-05 -2.0660204E-05 -2.8823093E-05 1.7997845E-02 4f 5f 1 7.5696613E+03 2.5448931E-05 -1.2862251E-05 2 2.4109604E+03 3.3499932E-04 -1.7139711E-04 3 9.9391221E+02 2.4262468E-03 -1.2361732E-03 4 4.6727769E+02 1.2246267E-02 -6.2953862E-03 5 2.3879068E+02 4.4344869E-02 -2.2773826E-02 6 1.2828739E+02 1.1951114E-01 -6.1981213E-02 7 7.1474419E+01 2.3519317E-01 -1.1858252E-01 8 4.0508322E+01 3.2845408E-01 -1.5199181E-01 9 2.3278551E+01 3.0106973E-01 -7.9266638E-02 10 1.3373065E+01 1.5798151E-01 1.4729708E-01 11 7.5576700E+00 3.8723824E-02 3.6359877E-01 12 4.2169552E+00 2.6078983E-03 3.8152425E-01 13 2.2998596E+00 1.2935638E-04 2.2052047E-01 14 1.1952368E+00 -1.0628613E-04 6.3902102E-02 15 5.3507461E-01 3.6225851E-06 5.4533048E-03 16 2.0355074E-01 -8.0800039E-06 -2.3325586E-05 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2379926E+07 4.7963866E-03 -2.3091583E-03 1.1499768E-03 6.2169115E-04 -3.3975054E-04 1.7399843E-04 -7.1571564E-05 2 1.3924329E+07 9.7175088E-03 -4.6950426E-03 2.3399206E-03 1.2652488E-03 -6.9149597E-04 3.5414576E-04 -1.4567312E-04 3 4.7322187E+06 1.5937268E-02 -7.7339457E-03 3.8578961E-03 2.0865661E-03 -1.1404457E-03 5.8408601E-04 -2.4025767E-04 4 1.7765482E+06 2.3927192E-02 -1.1700718E-02 5.8450089E-03 3.1625540E-03 -1.7287775E-03 8.8542561E-04 -3.6420737E-04 5 7.3036170E+05 3.4841604E-02 -1.7208180E-02 8.6125973E-03 4.6623356E-03 -2.5489601E-03 1.3055622E-03 -5.3702859E-04 6 3.1755048E+05 4.9232471E-02 -2.4682651E-02 1.2388579E-02 6.7113119E-03 -3.6703890E-03 1.8803180E-03 -7.7351701E-04 7 1.4562739E+05 6.8651258E-02 -3.5061319E-02 1.7661956E-02 9.5760265E-03 -5.2373039E-03 2.6829176E-03 -1.1036565E-03 8 6.9505217E+04 9.3857424E-02 -4.9101922E-02 2.4852668E-02 1.3489710E-02 -7.3794035E-03 3.7799048E-03 -1.5548832E-03 9 3.4513516E+04 1.2543760E-01 -6.7376551E-02 3.4295674E-02 1.8651371E-02 -1.0210551E-02 5.2315487E-03 -2.1521573E-03 10 1.7739932E+04 1.6087764E-01 -8.8887168E-02 4.5510869E-02 2.4795761E-02 -1.3587436E-02 6.9637445E-03 -2.8651331E-03 11 9.4501659E+03 1.9134067E-01 -1.0779648E-01 5.5357915E-02 3.0172133E-02 -1.6530416E-02 8.4723465E-03 -3.4852996E-03 12 5.2204463E+03 1.9894647E-01 -1.1017122E-01 5.5991347E-02 3.0397960E-02 -1.6643752E-02 8.5239384E-03 -3.5069043E-03 13 3.0177305E+03 1.6542253E-01 -7.3483171E-02 3.3479946E-02 1.7494595E-02 -9.4281045E-03 4.8168087E-03 -1.9785551E-03 14 1.8496131E+03 1.0041733E-01 4.3145744E-03 -1.6807050E-02 -1.1752107E-02 6.7894898E-03 -3.5588328E-03 1.4641289E-03 15 1.2410420E+03 4.2369085E-02 8.7599515E-02 -7.5052638E-02 -4.6540363E-02 2.6731213E-02 -1.3827571E-02 5.7193542E-03 16 8.5987447E+02 2.0083616E-02 1.8630553E-01 -1.6370493E-01 -1.0293637E-01 5.8517615E-02 -3.0426921E-02 1.2529783E-02 17 5.7548802E+02 3.0131185E-03 3.0220686E-01 -2.8937793E-01 -1.8781299E-01 1.0910190E-01 -5.6773143E-02 2.3480655E-02 18 3.7079951E+02 5.3198997E-04 3.0958030E-01 -3.3554807E-01 -2.2526681E-01 1.3085093E-01 -6.8397852E-02 2.8211257E-02 19 2.3442462E+02 -5.6574618E-04 1.7480737E-01 -1.0823900E-01 -5.8583184E-02 3.3835006E-02 -1.7449534E-02 7.2683713E-03 20 1.4620622E+02 2.0040751E-04 4.1503361E-02 3.5826013E-01 4.0543251E-01 -2.8155695E-01 1.5463357E-01 -6.4778603E-02 21 9.4492348E+01 -3.7645387E-04 2.1959128E-03 5.3870557E-01 7.2922672E-01 -5.2786370E-01 2.9424879E-01 -1.2312796E-01 22 6.2359752E+01 2.5665144E-04 5.6692060E-04 3.4380691E-01 4.5649961E-01 -3.3081591E-01 1.8454322E-01 -7.7929044E-02 23 4.0663476E+01 -2.9859348E-04 -4.1419304E-04 1.0764109E-01 -1.2567533E-01 1.4738446E-01 -7.8613920E-02 3.3136769E-02 24 2.9045340E+01 2.2123690E-04 9.3749635E-05 5.8456210E-03 -6.7039600E-01 8.9973406E-01 -6.3738400E-01 2.8208683E-01 25 1.9196278E+01 -1.2825994E-04 -1.2181621E-04 5.0436682E-03 -6.2428082E-01 1.0248368E+00 -7.2302764E-01 3.1952958E-01 26 1.2128714E+01 6.5091049E-05 3.4985261E-05 -1.5984009E-03 -1.7934966E-01 -1.3378393E-01 2.1831054E-01 -1.0608396E-01 27 7.5552708E+00 -4.2727837E-05 -1.2070208E-05 7.0590457E-04 -1.0929122E-02 -9.5923840E-01 1.1398645E+00 -5.7314504E-01 28 4.7621210E+00 2.6240362E-05 1.5750640E-05 -5.8683868E-04 -1.9528878E-03 -5.4066762E-01 8.1167882E-01 -4.5849604E-01 29 3.0890304E+00 -1.5110454E-05 -6.6262258E-06 2.8434514E-04 4.6613608E-04 -1.1229460E-01 -2.5436630E-01 2.0685204E-01 30 1.8607094E+00 6.2409864E-06 6.9624686E-07 -1.1516782E-04 -1.5655309E-04 -8.4862180E-03 -8.9494252E-01 7.5101984E-01 31 1.0735002E+00 -2.4749373E-06 -2.0379165E-06 5.1168784E-05 1.0455641E-04 3.4319072E-04 -5.3224461E-01 5.7694810E-01 32 5.6343614E-01 9.8035224E-07 -1.3941832E-08 -1.7891283E-05 -2.2983243E-05 -8.0819209E-05 -7.1551434E-02 -2.5032100E-01 33 2.9974166E-01 -4.0829711E-07 -2.7091449E-07 7.4044124E-06 1.0964830E-05 3.0148873E-05 2.8693622E-04 -7.0431803E-01 34 1.4931976E-01 9.9293690E-08 6.1184369E-09 -2.3998818E-06 -3.8553291E-06 -4.9016343E-06 -3.5962546E-04 -4.4534559E-01 35 6.5359317E-02 -3.1656104E-08 -1.1091648E-08 3.3633990E-07 5.0359175E-07 1.3356852E-06 1.3428376E-04 -6.2102674E-02 2p 3p 4p 5p 6p 7p 1 8.9528327E+07 2.7015080E-06 -1.4929852E-06 8.3130720E-07 -4.4915609E-07 2.1143042E-07 -6.6934289E-08 2 3.9254436E+07 2.7945715E-05 -1.5390134E-05 8.5096519E-06 -4.5708349E-06 2.1385997E-06 -6.7621156E-07 3 1.6889040E+07 6.7891337E-05 -3.7440143E-05 2.0724926E-05 -1.1157106E-05 5.2338226E-06 -1.6557896E-06 4 7.4319801E+06 1.3535338E-04 -7.4683578E-05 4.1309203E-05 -2.2194746E-05 1.0386880E-05 -3.2844239E-06 5 3.3430260E+06 2.5228724E-04 -1.3953181E-04 7.7285327E-05 -4.1610988E-05 1.9518881E-05 -6.1749941E-06 6 1.5331357E+06 4.5868994E-04 -2.5407349E-04 1.4066185E-04 -7.5601491E-05 3.5386571E-05 -1.1189921E-05 7 7.1481868E+05 8.2547778E-04 -4.5870326E-04 2.5433689E-04 -1.3696993E-04 6.4248221E-05 -2.0325439E-05 8 3.3842964E+05 1.4830928E-03 -8.2646530E-04 4.5820314E-04 -2.4639912E-04 1.1535888E-04 -3.6480440E-05 9 1.6259215E+05 2.6770586E-03 -1.4988055E-03 8.3246740E-04 -4.4850827E-04 2.1038298E-04 -6.6556356E-05 10 7.9242618E+04 4.8858873E-03 -2.7495669E-03 1.5280336E-03 -8.2236725E-04 3.8513931E-04 -1.2180168E-04 11 3.9170466E+04 9.0754629E-03 -5.1456635E-03 2.8668367E-03 -1.5458777E-03 7.2521856E-04 -2.2943308E-04 12 1.9647657E+04 1.7204126E-02 -9.8437524E-03 5.4936548E-03 -2.9605511E-03 1.3871488E-03 -4.3872910E-04 13 1.0020777E+04 3.3094466E-02 -1.9172693E-02 1.0741805E-02 -5.8018786E-03 2.7229147E-03 -8.6149667E-04 14 5.2109283E+03 6.3444284E-02 -3.7350226E-02 2.1002263E-02 -1.1343280E-02 5.3181900E-03 -1.6822310E-03 15 2.7675752E+03 1.1686029E-01 -7.0271205E-02 3.9775360E-02 -2.1551569E-02 1.0123602E-02 -3.2034974E-03 16 1.5014692E+03 1.9517534E-01 -1.2031144E-01 6.8516552E-02 -3.7136747E-02 1.7425225E-02 -5.5126241E-03 17 8.3196656E+02 2.7151655E-01 -1.7001290E-01 9.7377695E-02 -5.2988271E-02 2.4932456E-02 -7.8921913E-03 18 4.7044328E+02 2.7752798E-01 -1.5272443E-01 8.1945577E-02 -4.3347779E-02 2.0152326E-02 -6.3639326E-03 19 2.7074129E+02 1.7677542E-01 2.0047373E-02 -4.4358407E-02 2.9783939E-02 -1.4636538E-02 4.6666289E-03 20 1.5872313E+02 5.4988127E-02 3.1075745E-01 -2.8789530E-01 1.8038320E-01 -8.8402025E-02 2.8190285E-02 21 9.4890277E+01 6.0950132E-03 4.4133219E-01 -4.1334521E-01 2.5534310E-01 -1.2356303E-01 3.9295512E-02 22 5.6801830E+01 9.4819304E-05 2.7078869E-01 -1.0787616E-01 3.3924491E-02 -1.3346980E-02 4.0909201E-03 23 3.4091498E+01 -7.6510094E-05 6.3372424E-02 4.4098652E-01 -4.4843726E-01 2.5293286E-01 -8.2749462E-02 24 2.0835533E+01 -6.9229194E-05 4.6145539E-03 5.5559400E-01 -6.0783041E-01 3.4031886E-01 -1.1095075E-01 25 1.2557672E+01 3.4265841E-05 -2.0113486E-04 2.2496725E-01 6.1040579E-02 -1.0068685E-01 3.6816390E-02 26 7.4761806E+00 -1.3868608E-05 4.1743133E-06 2.6349964E-02 6.5880113E-01 -5.6755116E-01 2.0054952E-01 27 4.4604272E+00 1.8791747E-05 -1.8133356E-04 2.0416669E-03 4.6939246E-01 -4.1270366E-01 1.4728970E-01 28 2.6411534E+00 -1.1320444E-05 1.0259423E-04 -5.7900564E-04 1.1071907E-01 2.4084694E-01 -1.1961853E-01 29 1.5537526E+00 6.4266649E-06 -5.9920950E-05 2.7372253E-04 8.5768070E-03 5.8069714E-01 -2.8477861E-01 30 9.0207730E-01 -4.1941084E-06 3.9916052E-05 -2.0875033E-04 3.6806543E-04 3.9671653E-01 -2.1563648E-01 31 5.0791756E-01 1.8494212E-06 -1.8156008E-05 9.3301951E-05 -1.0089713E-04 1.1206130E-01 5.8524235E-02 32 2.6603230E-01 -8.5131791E-07 8.2309826E-06 -4.0097427E-05 -6.5113881E-05 1.2342049E-02 3.6036692E-01 33 1.3325972E-01 3.7697114E-07 -3.6966664E-06 1.9209068E-05 -1.5824828E-05 1.3489569E-03 4.6220118E-01 34 6.4549101E-02 -1.3592115E-07 1.3405351E-06 -6.5027342E-06 -1.0494787E-05 4.2635077E-04 2.7781106E-01 35 3.0167973E-02 3.6817472E-08 -3.6278258E-07 1.8708797E-06 -7.1743523E-07 4.9579105E-05 4.2125670E-02 3d 4d 5d 6d 1 1.3935969E+06 2.6513604E-06 -1.6143385E-06 8.4495147E-07 -3.2792829E-07 2 3.1789037E+05 1.3303717E-05 -8.1387432E-06 4.2788615E-06 -1.6654885E-06 3 9.7293283E+04 5.5363846E-05 -3.3858142E-05 1.7756535E-05 -6.8973579E-06 4 3.5121936E+04 2.0714455E-04 -1.2720229E-04 6.6895029E-05 -2.6029778E-05 5 1.4225588E+04 7.3064210E-04 -4.4982961E-04 2.3647343E-04 -9.1935084E-05 6 6.2939990E+03 2.4864796E-03 -1.5376176E-03 8.0980737E-04 -3.1513935E-04 7 2.9922028E+03 8.0451899E-03 -5.0048490E-03 2.6393954E-03 -1.0270604E-03 8 1.5082068E+03 2.3904163E-02 -1.4982605E-02 7.9187939E-03 -3.0838351E-03 9 7.9626924E+02 6.2934043E-02 -3.9974581E-02 2.1207894E-02 -8.2645537E-03 10 4.3664660E+02 1.4028178E-01 -9.0207923E-02 4.8011874E-02 -1.8726912E-02 11 2.4637439E+02 2.4742982E-01 -1.5844216E-01 8.4270027E-02 -3.2858913E-02 12 1.4220393E+02 3.1946063E-01 -1.9001078E-01 9.8317113E-02 -3.8075048E-02 13 8.3336868E+01 2.6381412E-01 -6.7146823E-02 1.4395014E-02 -3.5156793E-03 14 4.9198353E+01 1.2158576E-01 2.1379430E-01 -1.7207946E-01 7.2898064E-02 15 2.9229199E+01 2.4076123E-02 4.3709540E-01 -3.3432250E-01 1.4123803E-01 16 1.7476321E+01 1.5577763E-03 3.4238202E-01 -1.6075628E-01 5.2502755E-02 17 1.0394349E+01 -1.0842302E-04 1.1716503E-01 2.8531539E-01 -1.6759245E-01 18 6.0764938E+00 -6.4416463E-05 1.4120153E-02 5.1069270E-01 -2.9015168E-01 19 3.5085826E+00 -4.6830861E-05 6.6322670E-04 3.1940479E-01 -1.0471444E-01 20 1.9769630E+00 4.9952298E-06 -1.1592283E-05 7.9659455E-02 2.5762546E-01 21 1.0814289E+00 -5.7101982E-06 6.6539703E-06 5.9367416E-03 4.5097206E-01 22 5.7122110E-01 2.3650853E-06 -7.3509248E-06 3.3435978E-04 3.5052389E-01 23 2.8647155E-01 -9.8523202E-07 4.9556951E-06 -1.1255710E-04 1.3741729E-01 24 1.2659727E-01 1.9321427E-07 -1.4592202E-07 -8.3933745E-06 1.8004467E-02 4f 5f 1 7.5696613E+03 5.1517756E-05 -2.6069536E-05 2 2.4109604E+03 4.6557639E-04 -2.3817673E-04 3 9.9391221E+02 2.8682629E-03 -1.4622877E-03 4 4.6727769E+02 1.3378272E-02 -6.8805627E-03 5 2.3879068E+02 4.6491164E-02 -2.3889056E-02 6 1.2828739E+02 1.2253938E-01 -6.3581860E-02 7 7.1474419E+01 2.3822678E-01 -1.2012980E-01 8 4.0508322E+01 3.3050557E-01 -1.5291990E-01 9 2.3278551E+01 3.0183802E-01 -7.9253078E-02 10 1.3373065E+01 1.5815264E-01 1.4785963E-01 11 7.5576700E+00 3.8797964E-02 3.6405007E-01 12 4.2169552E+00 2.6707159E-03 3.8170125E-01 13 2.2998596E+00 1.6011067E-04 2.2056027E-01 14 1.1952368E+00 -8.8629804E-05 6.3918577E-02 15 5.3507461E-01 1.0661294E-05 5.4642174E-03 16 2.0355074E-01 -4.9578192E-06 -1.8784496E-05 ** Uus 292 ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2592404E+07 2.1377872E-03 -1.0290190E-03 5.1332302E-04 -2.7789251E-04 -1.5236224E-04 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7.5965169E+00 -4.0282728E-05 -1.2519192E-04 -4.9988965E-04 1.4994383E-02 -9.4767040E-01 1.1807409E+00 6.1111538E-01 28 4.7837346E+00 2.4176298E-05 8.4596573E-05 1.8736485E-04 -1.0016169E-03 -5.2395942E-01 7.5115725E-01 4.4369774E-01 29 2.9218573E+00 -1.4597587E-05 -4.9574511E-05 -1.3853068E-04 9.2403069E-04 -8.7686150E-02 -4.0616942E-01 -3.4714912E-01 30 1.8205439E+00 8.8253874E-06 2.8765390E-05 9.2587533E-05 -5.4268902E-04 -2.0782193E-04 -8.4451919E-01 -7.2740350E-01 31 1.1198384E+00 -4.4902069E-06 -1.5422712E-05 -4.1503538E-05 2.2275157E-04 -1.3007480E-03 -4.3633758E-01 -5.5540618E-01 32 6.8740009E-01 1.7709668E-06 5.9024097E-06 1.8141060E-05 -1.0072582E-04 4.5643891E-04 -8.8596069E-02 2.1082128E-01 33 3.5178324E-01 -4.6838462E-07 -1.5478154E-06 -4.8565773E-06 2.5948896E-05 -1.0578348E-04 -5.5230143E-03 7.2918755E-01 34 1.7389585E-01 1.2761196E-07 4.4857688E-07 1.1582634E-06 -6.0458172E-06 3.1587960E-05 6.1770983E-04 4.9520525E-01 35 7.5312455E-02 -2.2592953E-08 -7.1930765E-08 -2.5649397E-07 1.4011831E-06 -4.9877130E-06 2.2444952E-05 7.1426384E-02 2p 3p 4p 5p 6p 7p 1 8.9324682E+07 7.1704468E-06 -3.9698788E-06 2.1994743E-06 -1.1874678E-06 5.6372775E-07 -1.8826702E-07 2 3.8971244E+07 3.4562893E-05 -1.9124505E-05 1.0593217E-05 -5.7181682E-06 2.7143000E-06 -9.0646970E-07 3 1.6694350E+07 7.8826581E-05 -4.3629487E-05 2.4170261E-05 -1.3048563E-05 6.1943892E-06 -2.0687165E-06 4 7.3155498E+06 1.5089732E-04 -8.3558969E-05 4.6293354E-05 -2.4990378E-05 1.1862605E-05 -3.9616552E-06 5 3.2771361E+06 2.7027778E-04 -1.4978314E-04 8.3006813E-05 -4.4817116E-05 2.1276291E-05 -7.1056120E-06 6 1.4973698E+06 4.7181394E-04 -2.6177615E-04 1.4510307E-04 -7.8341116E-05 3.7188552E-05 -1.2419613E-05 7 6.9607021E+05 8.1670703E-04 -4.5393797E-04 2.5176634E-04 -1.3596960E-04 6.4555248E-05 -2.1559780E-05 8 3.2875270E+05 1.4195679E-03 -7.9111920E-04 4.3902867E-04 -2.3710644E-04 1.1256236E-04 -3.7592180E-05 9 1.5754465E+05 2.5054642E-03 -1.4017742E-03 7.7885839E-04 -4.2087325E-04 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-8.8662233E-02 29 1.7419261E+00 2.1088713E-05 -9.2008794E-05 1.4135396E-04 1.2541068E-02 5.9128848E-01 -3.0876779E-01 30 1.0089245E+00 -1.2132901E-05 5.6847248E-05 -1.4578711E-04 7.8207702E-04 4.3934529E-01 -2.5813768E-01 31 5.6942178E-01 5.7440044E-06 -2.6109276E-05 6.2290419E-05 -2.2392600E-04 1.2758791E-01 5.0083258E-02 32 3.0195650E-01 -2.5717296E-06 1.1775232E-05 -2.6359905E-05 -3.1770407E-05 1.4715382E-02 3.7280567E-01 33 1.5252401E-01 1.1066467E-06 -5.1811919E-06 1.3860072E-05 -4.3841624E-05 1.6934477E-03 4.7134201E-01 34 7.3830413E-02 -4.0045157E-07 1.8142391E-06 -3.8537830E-06 -6.7648672E-06 5.6971884E-04 2.7275892E-01 35 3.4331197E-02 1.0376345E-07 -4.8535561E-07 1.2742079E-06 -2.9473746E-06 5.7648062E-05 3.8245352E-02 3d 4d 5d 6d 1 1.3229736E+06 2.8115698E-06 -1.7242845E-06 9.1065923E-07 -3.6413260E-07 2 3.0141057E+05 1.3599860E-05 -8.3428972E-06 4.4043880E-06 -1.7604930E-06 3 9.2387675E+04 5.4972834E-05 -3.3795478E-05 1.7863210E-05 -7.1446237E-06 4 3.3363114E+04 2.0492536E-04 -1.2617043E-04 6.6667176E-05 -2.6651670E-05 5 1.3513413E+04 7.3825620E-04 -4.5645075E-04 2.4166647E-04 -9.6699533E-05 6 5.9828890E+03 2.5837589E-03 -1.6029319E-03 8.4873631E-04 -3.3946224E-04 7 2.8477309E+03 8.5528256E-03 -5.3424205E-03 2.8366006E-03 -1.1357873E-03 8 1.4369726E+03 2.5734730E-02 -1.6191036E-02 8.6067592E-03 -3.4455888E-03 9 7.5924995E+02 6.7969771E-02 -4.3372765E-02 2.3170043E-02 -9.2909314E-03 10 4.1648189E+02 1.5010707E-01 -9.6786775E-02 5.1792358E-02 -2.0765356E-02 11 2.3490804E+02 2.5890704E-01 -1.6576614E-01 8.8690456E-02 -3.5584222E-02 12 1.3558587E+02 3.2023595E-01 -1.8543395E-01 9.5066502E-02 -3.7659923E-02 13 7.9342888E+01 2.4835012E-01 -3.6304838E-02 -6.1504851E-03 5.0016086E-03 14 4.6730388E+01 1.0373502E-01 2.5565483E-01 -2.0345153E-01 8.8850209E-02 15 2.7854869E+01 1.7362547E-02 4.4334933E-01 -3.3829262E-01 1.4624229E-01 16 1.6665360E+01 1.2182422E-03 3.1024920E-01 -1.0351312E-01 2.4832353E-02 17 9.9036870E+00 -2.7496013E-04 9.3290990E-02 3.4128909E-01 -2.0427898E-01 18 5.8232484E+00 3.1709056E-05 9.3119301E-03 5.0090246E-01 -2.9236163E-01 19 3.3874808E+00 -9.1452939E-05 6.1661465E-04 2.7804560E-01 -6.0904159E-02 20 1.9331291E+00 3.4058165E-05 -1.0348948E-04 6.2506782E-02 3.0016924E-01 21 1.0691248E+00 -1.9324962E-05 4.3413720E-05 4.2655566E-03 4.5765674E-01 22 5.6984084E-01 8.3569183E-06 -2.0308696E-05 1.5369591E-04 3.2004395E-01 23 2.8748542E-01 -3.1450622E-06 1.0504185E-05 -1.0626992E-04 1.0993589E-01 24 1.2603693E-01 6.8281359E-07 -1.2608243E-06 -1.4498361E-05 1.2057006E-02 4f 5f 1 7.8705299E+03 4.5289220E-05 -2.3256188E-05 2 2.5020499E+03 4.2704050E-04 -2.2125919E-04 3 1.0299379E+03 2.6990773E-03 -1.3943361E-03 4 4.8369691E+02 1.2797608E-02 -6.6680457E-03 5 2.4699623E+02 4.5064628E-02 -2.3460308E-02 6 1.3263515E+02 1.2002375E-01 -6.3092878E-02 7 7.3889268E+01 2.3549161E-01 -1.2040179E-01 8 4.1894295E+01 3.2920670E-01 -1.5459611E-01 9 2.4098604E+01 3.0284057E-01 -8.1880019E-02 10 1.3870684E+01 1.6003403E-01 1.4630111E-01 11 7.8660404E+00 3.9815581E-02 3.6396309E-01 12 4.4199098E+00 2.8276678E-03 3.7974467E-01 13 2.4438504E+00 1.7948427E-04 2.1893564E-01 14 1.2954819E+00 -9.4897181E-05 6.4855697E-02 15 5.8728545E-01 1.1578022E-05 5.6653654E-03 16 2.2777031E-01 -5.2144511E-06 -5.1077808E-05 Pseudo-large component functions -------------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2592404E+07 4.2455541E-05 -2.0354147E-05 1.0145888E-05 -5.4914760E-06 -3.0106667E-06 1.5551452E-06 6.5376437E-07 2 1.3978664E+07 2.6162793E-04 -1.2545910E-04 6.2540083E-05 -3.3850367E-05 -1.8558392E-05 9.5862451E-06 4.0299704E-06 3 4.7485662E+06 7.8541391E-04 -3.7719995E-04 1.8808751E-04 -1.0181196E-04 -5.5819227E-05 2.8833407E-05 1.2121208E-05 4 1.7811678E+06 2.1142790E-03 -1.0167691E-03 5.0714284E-04 -2.7453822E-04 -1.5052252E-04 7.7752679E-05 3.2686793E-05 5 7.3153250E+05 4.8811240E-03 -2.3518093E-03 1.1735363E-03 -6.3535567E-04 -3.4835739E-04 1.7994729E-04 7.5647362E-05 6 3.1773186E+05 1.0731363E-02 -5.1816056E-03 2.5868971E-03 -1.4007604E-03 -7.6806745E-04 3.9675510E-04 1.6679635E-04 7 1.4557095E+05 2.1613721E-02 -1.0468624E-02 5.2309030E-03 -2.8330821E-03 -1.5535071E-03 8.0250901E-04 3.3736105E-04 8 6.9383090E+04 4.1433514E-02 -2.0154697E-02 1.0083217E-02 -5.4631206E-03 -2.9961345E-03 1.5477681E-03 6.5070836E-04 9 3.4369147E+04 7.2896868E-02 -3.5683079E-02 1.7889139E-02 -9.6977989E-03 -5.3191305E-03 2.7480115E-03 1.1551899E-03 10 1.7596622E+04 1.1823747E-01 -5.8331488E-02 2.9322519E-02 -1.5908928E-02 -8.7290388E-03 4.5098117E-03 1.8962237E-03 11 9.3292167E+03 1.6683835E-01 -8.2594607E-02 4.1614947E-02 -2.2590010E-02 -1.2393994E-02 6.4041719E-03 2.6916326E-03 12 5.1287822E+03 1.9813755E-01 -9.5099758E-02 4.7457599E-02 -2.5692588E-02 -1.4093362E-02 7.2785168E-03 3.0625934E-03 13 2.9810020E+03 1.6606876E-01 -6.3148538E-02 2.8470291E-02 -1.4858450E-02 -8.0198147E-03 4.1331884E-03 1.7243792E-03 14 2.0043865E+03 8.7010754E-02 -1.1536652E-02 -1.1253512E-03 1.7562975E-03 1.0825636E-03 -6.0743825E-04 -2.2559016E-04 15 1.4317046E+03 7.5728496E-02 6.3186049E-02 -5.5731282E-02 3.4723635E-02 1.9974028E-02 -1.0422213E-02 -4.4427260E-03 16 8.8476322E+02 3.8194443E-02 2.2719435E-01 -1.9423780E-01 1.2136884E-01 6.9360181E-02 -3.6334217E-02 -1.5257174E-02 17 5.4604920E+02 3.0265510E-04 3.4121960E-01 -3.2364511E-01 2.1044429E-01 1.2238305E-01 -6.4243910E-02 -2.7230259E-02 18 3.4698710E+02 5.4103089E-03 2.8124174E-01 -2.9913520E-01 2.0043234E-01 1.1686749E-01 -6.1695340E-02 -2.5835534E-02 19 2.2649864E+02 -5.6300096E-03 1.4698265E-01 -4.9140496E-02 1.3142401E-02 6.0212299E-03 -2.6227290E-03 -1.4711820E-03 20 1.4472710E+02 6.3042957E-03 3.5530832E-02 3.6504802E-01 -4.2024592E-01 -2.9485058E-01 1.6357777E-01 7.0715545E-02 21 9.5774498E+01 -7.3272007E-03 3.7238177E-03 5.1022065E-01 -6.8007309E-01 -4.9178352E-01 2.7669282E-01 1.1721911E-01 22 6.4200143E+01 7.6765389E-03 -1.2908624E-03 3.3307082E-01 -4.6816164E-01 -3.4753994E-01 1.9668101E-01 8.6903086E-02 23 4.3351340E+01 -6.9695901E-03 1.7210503E-03 1.0806401E-01 1.6579070E-01 1.9562497E-01 -1.1380484E-01 -5.2318680E-02 24 2.8436958E+01 5.7647020E-03 -1.7885807E-03 1.7239453E-02 7.6715279E-01 1.0594033E+00 -7.5764793E-01 -3.4018958E-01 25 1.8507819E+01 -4.7959918E-03 1.5295830E-03 -9.9387525E-04 5.3895773E-01 9.0456891E-01 -6.4176085E-01 -2.9454490E-01 26 1.2173391E+01 3.6873778E-03 -1.2565011E-03 1.2056078E-03 1.3698822E-01 -2.6670499E-01 3.3044449E-01 1.6649435E-01 27 7.5965169E+00 -2.6982216E-03 9.7908417E-04 -9.6737477E-04 1.5265257E-02 -9.4780860E-01 1.1802732E+00 6.1079088E-01 28 4.7837346E+00 2.0765633E-03 -7.6964545E-04 5.4822883E-04 -1.1783150E-03 -5.2450607E-01 7.5157168E-01 4.4391981E-01 29 2.9218573E+00 -1.6072741E-03 6.1441965E-04 -4.1875133E-04 1.0605642E-03 -8.7666398E-02 -4.0609154E-01 -3.4699459E-01 30 1.8205439E+00 1.2366291E-03 -4.8378139E-04 3.0870065E-04 -6.4736722E-04 -2.8196730E-04 -8.4456429E-01 -7.2735613E-01 31 1.1198384E+00 -8.2440128E-04 3.2719897E-04 -1.8576946E-04 2.9229320E-04 -1.2529816E-03 -4.3644559E-01 -5.5544836E-01 32 6.8740009E-01 4.2471383E-04 -1.7098225E-04 9.2547894E-05 -1.3650990E-04 4.3177229E-04 -8.8595901E-02 2.1080748E-01 33 3.5178324E-01 -1.6551224E-04 6.7538147E-05 -3.3883334E-05 3.9874593E-05 -9.6141356E-05 -5.5301942E-03 7.2919290E-01 34 1.7389585E-01 7.0455451E-05 -2.9008105E-05 1.3522017E-05 -1.1964931E-05 2.7473240E-05 6.2049393E-04 4.9521644E-01 35 7.5312455E-02 -2.1562353E-05 8.9547786E-06 -4.0423471E-06 3.2117574E-06 -3.7246527E-06 2.1615170E-05 7.1427369E-02 2p 3p 4p 5p 6p 7p 1 8.9324682E+07 4.7331279E-08 -2.6220904E-08 1.4540247E-08 -7.8585086E-09 3.7336255E-09 -1.2471102E-09 2 3.8971244E+07 3.4459708E-07 -1.9101121E-07 1.0580456E-07 -5.7084325E-08 2.7084719E-08 -9.0444134E-09 3 1.6694350E+07 1.2696827E-06 -7.0432475E-07 3.9056895E-07 -2.1100595E-07 1.0021520E-07 -3.3471625E-08 4 7.3155498E+06 3.8147474E-06 -2.1185445E-06 1.1741753E-06 -6.3365931E-07 3.0068796E-07 -1.0041128E-07 5 3.2771361E+06 1.0556531E-05 -5.8721683E-06 3.2586063E-06 -1.7608088E-06 8.3631374E-07 -2.7932880E-07 6 1.4973698E+06 2.8115769E-05 -1.5672375E-05 8.6947333E-06 -4.6936260E-06 2.2274421E-06 -7.4384081E-07 7 6.9607021E+05 7.3620517E-05 -4.1147383E-05 2.2861904E-05 -1.2357967E-05 5.8700804E-06 -1.9606404E-06 8 3.2875270E+05 1.9151048E-04 -1.0737913E-04 5.9664286E-05 -3.2223793E-05 1.5294643E-05 -5.1076976E-06 9 1.5754465E+05 4.9796519E-04 -2.8026777E-04 1.5599817E-04 -8.4366095E-05 4.0078784E-05 -1.3386821E-05 10 7.6517657E+04 1.2959748E-03 -7.3262022E-04 4.0796298E-04 -2.2048826E-04 1.0467559E-04 -3.4958255E-05 11 3.7655472E+04 3.3583672E-03 -1.9085837E-03 1.0649842E-03 -5.7635673E-04 2.7384676E-04 -9.1470961E-05 12 1.8802319E+04 8.5580445E-03 -4.8964856E-03 2.7354813E-03 -1.4799167E-03 7.0279951E-04 -2.3472601E-04 13 9.5490048E+03 2.1061256E-02 -1.2164389E-02 6.8172984E-03 -3.6941468E-03 1.7558119E-03 -5.8651765E-04 14 4.9436064E+03 4.8809210E-02 -2.8586229E-02 1.6073047E-02 -8.7123986E-03 4.1396603E-03 -1.3827321E-03 15 2.6131537E+03 1.0254099E-01 -6.1263857E-02 3.4662775E-02 -1.8837974E-02 8.9612223E-03 -2.9939175E-03 16 1.4114600E+03 1.8480327E-01 -1.1317843E-01 6.4447155E-02 -3.5062123E-02 1.6675171E-02 -5.5708097E-03 17 7.7969409E+02 2.6328946E-01 -1.6294531E-01 9.3120225E-02 -5.0779418E-02 2.4184934E-02 -8.0819806E-03 18 4.4015329E+02 2.6138655E-01 -1.3399064E-01 6.9447475E-02 -3.6422570E-02 1.7110549E-02 -5.7026665E-03 19 2.5330674E+02 1.5167155E-01 6.0312716E-02 -7.4280703E-02 4.7748828E-02 -2.3671104E-02 7.9684778E-03 20 1.4899547E+02 3.7085004E-02 3.4714469E-01 -3.2171495E-01 2.0242464E-01 -1.0042724E-01 3.3817802E-02 21 8.9579212E+01 -9.4715623E-04 4.2336885E-01 -3.8804819E-01 2.3830637E-01 -1.1669994E-01 3.9192601E-02 22 5.4394369E+01 -4.6708320E-03 2.3075468E-01 -4.1865292E-02 -1.4514240E-02 1.1869751E-02 -4.2772199E-03 23 3.3714421E+01 -3.7300459E-03 5.0358070E-02 4.4105802E-01 -4.5346702E-01 2.6039082E-01 -9.0159356E-02 24 2.1316316E+01 -3.5179205E-03 5.1616707E-03 5.1503912E-01 -5.6627395E-01 3.2165274E-01 -1.1088234E-01 25 1.3296603E+01 -3.0958169E-03 -5.5791610E-04 2.3027424E-01 1.2288272E-02 -6.5657912E-02 2.6447034E-02 26 8.1370355E+00 -2.8204658E-03 1.8856739E-04 3.4087995E-02 6.0712730E-01 -5.2880095E-01 1.9792907E-01 27 4.9491723E+00 -2.6507950E-03 -2.7605111E-04 1.8205219E-03 5.1654884E-01 -4.7738017E-01 1.8215334E-01 28 2.9526792E+00 -2.1896794E-03 1.2912487E-04 -7.3071991E-04 1.4694918E-01 1.5363780E-01 -8.8579987E-02 29 1.7419261E+00 -2.3353693E-03 -6.5480080E-05 -3.5294985E-04 1.2620113E-02 5.9119645E-01 -3.0871252E-01 30 1.0089245E+00 -1.5691978E-03 3.5812860E-05 -4.3236323E-04 7.9849124E-04 4.3933198E-01 -2.5812737E-01 31 5.6942178E-01 -2.2072661E-03 -1.4152698E-05 -3.8818621E-04 -1.6702845E-04 1.2751255E-01 5.0096214E-02 32 3.0195650E-01 -1.1122413E-03 2.8840626E-06 -2.3696689E-04 -1.5212475E-05 1.4678596E-02 3.7281120E-01 33 1.5252401E-01 -2.3038193E-03 -1.5033956E-06 -4.4627290E-04 8.3408057E-06 1.6059008E-03 4.7136300E-01 34 7.3830413E-02 -1.5732229E-04 -1.1737585E-06 -3.1876102E-05 -5.7972361E-06 5.6506011E-04 2.7276136E-01 35 3.4331197E-02 -2.6561722E-03 -9.1166842E-07 -5.2422895E-04 5.3454893E-05 -4.1417630E-05 3.8268003E-02 3d 4d 5d 6d 1 1.3229736E+06 1.1360512E-07 -6.9929201E-08 3.7044259E-08 -1.4838961E-08 2 3.0141057E+05 1.3245433E-06 -8.1288272E-07 4.2851874E-07 -1.7108261E-07 3 9.2387675E+04 1.0583777E-05 -6.5274176E-06 3.4567426E-06 -1.3839501E-06 4 3.3363114E+04 6.8050359E-05 -4.1930317E-05 2.2146524E-05 -8.8497531E-06 5 1.3513413E+04 3.6731131E-04 -2.2723063E-04 1.2036435E-04 -4.8176403E-05 6 5.9828890E+03 1.6932253E-03 -1.0491825E-03 5.5524477E-04 -2.2202812E-04 7 2.8477309E+03 6.6763079E-03 -4.1626128E-03 2.2092297E-03 -8.8454022E-04 8 1.4369726E+03 2.2335131E-02 -1.4018410E-02 7.4465988E-03 -2.9805661E-03 9 7.5924995E+02 6.2809635E-02 -3.9982998E-02 2.1345529E-02 -8.5581510E-03 10 4.1648189E+02 1.4390628E-01 -9.2607876E-02 4.9530986E-02 -1.9856244E-02 11 2.3490804E+02 2.5343776E-01 -1.6208055E-01 8.6696714E-02 -3.4782458E-02 12 1.3558587E+02 3.1720460E-01 -1.8384199E-01 9.4327244E-02 -3.7376436E-02 13 7.9342888E+01 2.4724362E-01 -3.7025526E-02 -5.3985309E-03 4.6622638E-03 14 4.6730388E+01 1.0305768E-01 2.5426465E-01 -2.0220326E-01 8.8291458E-02 15 2.7854869E+01 1.6704649E-02 4.4274710E-01 -3.3769828E-01 1.4598467E-01 16 1.6665360E+01 6.8926773E-04 3.1024022E-01 -1.0386914E-01 2.5057795E-02 17 9.9036870E+00 -6.3235587E-04 9.3181295E-02 3.4090634E-01 -2.0401782E-01 18 5.8232484E+00 -2.2301156E-04 9.1799487E-03 5.0076764E-01 -2.9226013E-01 19 3.3874808E+00 -2.5583969E-04 5.0108086E-04 2.7803285E-01 -6.0958130E-02 20 1.9331291E+00 -8.7958971E-05 -1.7282000E-04 6.2448034E-02 3.0011911E-01 21 1.0691248E+00 -9.3162714E-05 -9.2040767E-06 4.2283173E-03 4.5763266E-01 22 5.6984084E-01 -5.0795587E-05 -5.4466502E-05 1.1604388E-04 3.2003873E-01 23 2.8748542E-01 -3.1282077E-05 -9.2298259E-06 -1.2126877E-04 1.0993072E-01 24 1.2603693E-01 -3.3347951E-05 -2.2217885E-05 -3.5060259E-05 1.2049504E-02 4f 5f 1 7.8705299E+03 2.4514317E-05 -1.2551035E-05 2 2.5020499E+03 3.2387350E-04 -1.6788959E-04 3 1.0299379E+03 2.3552505E-03 -1.2157035E-03 4 4.8369691E+02 1.1942155E-02 -6.2198270E-03 5 2.4699623E+02 4.3489820E-02 -2.2628649E-02 6 1.3263515E+02 1.1786623E-01 -6.1937871E-02 7 7.3889268E+01 2.3338475E-01 -1.1931250E-01 8 4.1894295E+01 3.2779020E-01 -1.5396102E-01 9 2.4098604E+01 3.0228759E-01 -8.1899962E-02 10 1.3870684E+01 1.5985273E-01 1.4593364E-01 11 7.8660404E+00 3.9718201E-02 3.6366657E-01 12 4.4199098E+00 2.7584391E-03 3.7962291E-01 13 2.4438504E+00 1.4761024E-04 2.1889769E-01 14 1.2954819E+00 -1.1398462E-04 6.4835096E-02 15 5.8728545E-01 3.8433022E-06 5.6528031E-03 16 2.2777031E-01 -8.7203398E-06 -5.6242717E-05 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2592404E+07 5.0736020E-03 -2.4568911E-03 1.2238260E-03 -6.6227950E-04 -3.6303868E-04 1.8752895E-04 7.8832694E-05 2 1.3978664E+07 1.0255247E-02 -4.9843201E-03 2.4847461E-03 -1.3449281E-03 -7.3728442E-04 3.8085048E-04 1.6010286E-04 3 4.7485662E+06 1.6769697E-02 -8.1868418E-03 4.0849326E-03 -2.2115996E-03 -1.2124956E-03 6.2634128E-04 2.6329525E-04 4 1.7811678E+06 2.5093038E-02 -1.2346953E-02 6.1699500E-03 -3.3418747E-03 -1.8323729E-03 9.4655358E-04 3.9790994E-04 5 7.3153250E+05 3.6405133E-02 -1.8093018E-02 9.0584908E-03 -4.9087435E-03 -2.6923364E-03 1.3912695E-03 5.8494439E-04 6 3.1773186E+05 5.1214427E-02 -2.5845409E-02 1.2978038E-02 -7.0371391E-03 -3.8590150E-03 1.9934472E-03 8.3801754E-04 7 1.4557095E+05 7.1092395E-02 -3.6546129E-02 1.8418813E-02 -9.9941144E-03 -5.4794104E-03 2.8296891E-03 1.1893704E-03 8 6.9383090E+04 9.6763963E-02 -5.0972225E-02 2.5829102E-02 -1.4054018E-02 -7.7211529E-03 3.9914653E-03 1.6783252E-03 9 3.4369147E+04 1.2891328E-01 -6.9664786E-02 3.5489325E-02 -1.9338975E-02 -1.0628144E-02 5.4945265E-03 2.3100616E-03 10 1.7596622E+04 1.6464955E-01 -9.1388878E-02 4.6707165E-02 -2.5426951E-02 -1.3964077E-02 7.2171258E-03 3.0351031E-03 11 9.3292167E+03 1.9458509E-01 -1.0955207E-01 5.6061166E-02 -3.0519050E-02 -1.6757160E-02 8.6609080E-03 3.6398981E-03 12 5.1287822E+03 1.9939086E-01 -1.0927206E-01 5.5255644E-02 -2.9979927E-02 -1.6449892E-02 8.4921594E-03 3.5737005E-03 13 2.9810020E+03 1.5299652E-01 -6.3300810E-02 2.7680388E-02 -1.4230408E-02 -7.6348033E-03 3.9334038E-03 1.6361032E-03 14 2.0043865E+03 6.5874894E-02 -3.4278485E-03 -6.5207633E-03 4.9663334E-03 2.8773409E-03 -1.5510775E-03 -6.1506432E-04 15 1.4317046E+03 6.6386423E-02 7.5312385E-02 -6.7549937E-02 4.2234207E-02 2.4288259E-02 -1.2665415E-02 -5.3971526E-03 16 8.8476322E+02 2.5741558E-02 2.4427672E-01 -2.1451636E-01 1.3495267E-01 7.7301229E-02 -4.0531507E-02 -1.7021735E-02 17 5.4604920E+02 2.0398119E-03 3.4221837E-01 -3.3568652E-01 2.1984897E-01 1.2810661E-01 -6.7274494E-02 -2.8522189E-02 18 3.4698710E+02 -2.2505835E-05 2.7609306E-01 -3.0064300E-01 2.0218469E-01 1.1801009E-01 -6.2335553E-02 -2.6095224E-02 19 2.2649864E+02 -5.0688930E-04 1.3800718E-01 -3.8828774E-02 4.3274016E-03 5.1515210E-04 3.4749085E-04 -2.2881220E-04 20 1.4472710E+02 7.1333654E-05 3.5325497E-02 3.7210907E-01 -4.3216712E-01 -3.0400756E-01 1.6879293E-01 7.2982446E-02 21 9.5774498E+01 -2.4701412E-04 3.1766283E-04 5.1075493E-01 -6.8499562E-01 -4.9590292E-01 2.7906478E-01 1.1821039E-01 22 6.4200143E+01 1.4053323E-04 1.6177657E-03 3.2849334E-01 -4.6538776E-01 -3.4594394E-01 1.9594383E-01 8.6643201E-02 23 4.3351340E+01 -1.3856630E-04 -1.1169896E-03 1.0731757E-01 1.7043333E-01 2.0105789E-01 -1.1732002E-01 -5.3913355E-02 24 2.8436958E+01 8.9307867E-05 5.2030987E-04 1.5888725E-02 7.6877157E-01 1.0639593E+00 -7.6142237E-01 -3.4192559E-01 25 1.8507819E+01 -6.6956443E-05 -4.2883937E-04 -2.5941431E-04 5.3685589E-01 9.0311204E-01 -6.4072657E-01 -2.9409076E-01 26 1.2173391E+01 3.9517925E-05 2.4583884E-04 5.5098725E-04 1.3654576E-01 -2.6862478E-01 3.3253731E-01 1.6753559E-01 27 7.5965169E+00 -2.6117780E-05 -1.3232544E-04 -5.1205889E-04 1.4928564E-02 -9.4805858E-01 1.1813239E+00 6.1143841E-01 28 4.7837346E+00 1.5113881E-05 8.4439614E-05 1.8631582E-04 -1.0295766E-03 -5.2383051E-01 7.5100543E-01 4.4364217E-01 29 2.9218573E+00 -9.5833593E-06 -5.2469769E-05 -1.3972766E-04 9.1692342E-04 -8.7609669E-02 -4.0642701E-01 -3.4733032E-01 30 1.8205439E+00 5.6636082E-06 2.8794913E-05 9.1731475E-05 -5.4251512E-04 -1.8845729E-04 -8.4458344E-01 -7.2746486E-01 31 1.1198384E+00 -3.0161645E-06 -1.6111101E-05 -4.3047918E-05 2.2223328E-04 -1.3004296E-03 -4.3630245E-01 -5.5539511E-01 32 6.8740009E-01 1.1038212E-06 5.8958183E-06 1.8054325E-05 -1.0180950E-04 4.5673902E-04 -8.8581853E-02 2.1085993E-01 33 3.5178324E-01 -3.4032770E-07 -1.7629147E-06 -4.9014643E-06 2.5967219E-05 -1.0498267E-04 -5.5221578E-03 7.2919574E-01 34 1.7389585E-01 7.2299034E-08 3.9312017E-07 1.0564065E-06 -6.0692281E-06 3.1367121E-05 6.1950259E-04 4.9520344E-01 35 7.5312455E-02 -2.0284674E-08 -1.0276002E-07 -2.6092620E-07 1.3979944E-06 -4.7443927E-06 2.2221175E-05 7.1424938E-02 2p 3p 4p 5p 6p 7p 1 8.9324682E+07 3.0317620E-06 -1.6809631E-06 9.3917997E-07 -5.0991879E-07 2.4304421E-07 -8.1238721E-08 2 3.8971244E+07 3.0039521E-05 -1.6572972E-05 9.1773703E-06 -4.9471625E-06 2.3457018E-06 -7.8316913E-07 3 1.6694350E+07 7.2884915E-05 -4.0281320E-05 2.2352032E-05 -1.2084358E-05 5.7429691E-06 -1.9184179E-06 4 7.3155498E+06 1.4547686E-04 -8.0417662E-05 4.4551545E-05 -2.4024374E-05 1.1393636E-05 -3.8042260E-06 5 3.2771361E+06 2.7158824E-04 -1.5053729E-04 8.3580875E-05 -4.5190521E-05 2.1475399E-05 -7.1736964E-06 6 1.4973698E+06 4.9410514E-04 -2.7421961E-04 1.5206747E-04 -8.2035378E-05 3.8912193E-05 -1.2992884E-05 7 6.9607021E+05 8.8936117E-04 -4.9531999E-04 2.7528531E-04 -1.4886957E-04 7.0744070E-05 -2.3631339E-05 8 3.2875270E+05 1.5985589E-03 -8.9266385E-04 4.9578064E-04 -2.6762052E-04 1.2697332E-04 -4.2399000E-05 9 1.5754465E+05 2.8912958E-03 -1.6226090E-03 9.0330341E-04 -4.8866422E-04 2.3221721E-04 -7.7569424E-05 10 7.6517657E+04 5.2982482E-03 -2.9886899E-03 1.6641448E-03 -8.9914546E-04 4.2675446E-04 -1.4251255E-04 11 3.7655472E+04 9.8851551E-03 -5.6199293E-03 3.1382557E-03 -1.6990308E-03 8.0747884E-04 -2.6973229E-04 12 1.8802319E+04 1.8801936E-02 -1.0790000E-02 6.0350265E-03 -3.2656504E-03 1.5507443E-03 -5.1791828E-04 13 9.5490048E+03 3.6275229E-02 -2.1087933E-02 1.1843429E-02 -6.4223239E-03 3.0534149E-03 -1.0200403E-03 14 4.9436064E+03 6.9644049E-02 -4.1168105E-02 2.3209763E-02 -1.2589845E-02 5.9828069E-03 -1.9984144E-03 15 2.6131537E+03 1.2769900E-01 -7.7142780E-02 4.3782753E-02 -2.3817058E-02 1.1333302E-02 -3.7866509E-03 16 1.4114600E+03 2.0970934E-01 -1.2988455E-01 7.4188920E-02 -4.0397223E-02 1.9216358E-02 -6.4199802E-03 17 7.7969409E+02 2.8105182E-01 -1.7544640E-01 1.0046530E-01 -5.4816870E-02 2.6113483E-02 -8.7268576E-03 18 4.4015329E+02 2.6914777E-01 -1.3720619E-01 7.0630978E-02 -3.6931851E-02 1.7331230E-02 -5.7749754E-03 19 2.5330674E+02 1.5491409E-01 6.5243850E-02 -7.9472215E-02 5.1047964E-02 -2.5304289E-02 8.5181065E-03 20 1.4899547E+02 4.1193072E-02 3.5225378E-01 -3.2842220E-01 2.0696670E-01 -1.0272469E-01 3.4594259E-02 21 8.9579212E+01 4.0090558E-03 4.2305967E-01 -3.8922102E-01 2.3908220E-01 -1.1707454E-01 3.9317870E-02 22 5.4394369E+01 -2.0356182E-04 2.2904529E-01 -3.8732753E-02 -1.7121367E-02 1.3246634E-02 -4.7461244E-03 23 3.3714421E+01 1.1937290E-04 4.9548655E-02 4.4392734E-01 -4.5680274E-01 2.6239387E-01 -9.0858587E-02 24 2.1316316E+01 -2.1826492E-04 5.1671282E-03 5.1520312E-01 -5.6683352E-01 3.2194835E-01 -1.1098125E-01 25 1.3296603E+01 1.4104669E-04 -6.4550043E-04 2.3034184E-01 1.3225135E-02 -6.6463924E-02 2.6743886E-02 26 8.1370355E+00 -8.4235188E-05 2.5258702E-04 3.4394538E-02 6.0755174E-01 -5.2942487E-01 1.9817965E-01 27 4.9491723E+00 6.3792574E-05 -3.2594499E-04 2.3952910E-03 5.1622228E-01 -4.7725411E-01 1.8211199E-01 28 2.9526792E+00 -3.7389153E-05 1.6845581E-04 -3.4925670E-04 1.4679752E-01 1.5391876E-01 -8.8716605E-02 29 1.7419261E+00 2.1367666E-05 -9.3429531E-05 1.4249760E-04 1.2530239E-02 5.9134115E-01 -3.0879699E-01 30 1.0089245E+00 -1.2313565E-05 5.7407228E-05 -1.4690334E-04 7.8079266E-04 4.3933957E-01 -2.5813835E-01 31 5.6942178E-01 5.8062914E-06 -2.6393852E-05 6.2579876E-05 -2.2422238E-04 1.2757986E-01 5.0093043E-02 32 3.0195650E-01 -2.6088592E-06 1.1887651E-05 -2.6529328E-05 -3.1857674E-05 1.4714155E-02 3.7281138E-01 33 1.5252401E-01 1.1209627E-06 -5.2382721E-06 1.3923164E-05 -4.3858311E-05 1.6931506E-03 4.7134333E-01 34 7.3830413E-02 -4.0614937E-07 1.8341276E-06 -3.8830465E-06 -6.7671553E-06 5.6971486E-04 2.7275834E-01 35 3.4331197E-02 1.0494476E-07 -4.9071008E-07 1.2813459E-06 -2.9551307E-06 5.7637318E-05 3.8245127E-02 3d 4d 5d 6d 1 1.3229736E+06 2.9904441E-06 -1.8276732E-06 9.6362706E-07 -3.8514499E-07 2 3.0141057E+05 1.5013280E-05 -9.2077568E-06 4.8643490E-06 -1.9447404E-06 3 9.2387675E+04 6.2501831E-05 -3.8363554E-05 2.0259814E-05 -8.1011471E-06 4 3.3363114E+04 2.3462965E-04 -1.4449853E-04 7.6391806E-05 -3.0544666E-05 5 1.3513413E+04 8.3034867E-04 -5.1310333E-04 2.7155639E-04 -1.0864489E-04 6 5.9828890E+03 2.8272829E-03 -1.7541727E-03 9.2902105E-04 -3.7160382E-04 7 2.8477309E+03 9.1162323E-03 -5.6938094E-03 3.0229222E-03 -1.2103490E-03 8 1.4369726E+03 2.6876444E-02 -1.6912490E-02 8.9913317E-03 -3.5996960E-03 9 7.5924995E+02 6.9940731E-02 -4.4648188E-02 2.3854072E-02 -9.5654088E-03 10 4.1648189E+02 1.5284133E-01 -9.8604629E-02 5.2774487E-02 -2.1160079E-02 11 2.3490804E+02 2.6161368E-01 -1.6760496E-01 8.9696607E-02 -3.5990200E-02 12 1.3558587E+02 3.2183235E-01 -1.8643312E-01 9.5590579E-02 -3.7868304E-02 13 7.9342888E+01 2.4858167E-01 -3.5870236E-02 -6.5085005E-03 5.1570437E-03 14 4.6730388E+01 1.0353763E-01 2.5665763E-01 -2.0419311E-01 8.9173145E-02 15 2.7854869E+01 1.7264797E-02 4.4395029E-01 -3.3880793E-01 1.4647117E-01 16 1.6665360E+01 1.2105727E-03 3.1023226E-01 -1.0332731E-01 2.4726099E-02 17 9.9036870E+00 -2.7898840E-04 9.3220139E-02 3.4159810E-01 -2.0445055E-01 18 5.8232484E+00 3.2855419E-05 9.2894620E-03 5.0101606E-01 -2.9243678E-01 19 3.3874808E+00 -9.2335936E-05 6.1761203E-04 2.7802395E-01 -6.0866211E-02 20 1.9331291E+00 3.4442583E-05 -1.0526376E-04 6.2494799E-02 3.0021472E-01 21 1.0691248E+00 -1.9528552E-05 4.4109262E-05 4.2626237E-03 4.5767483E-01 22 5.6984084E-01 8.4400561E-06 -2.0640390E-05 1.5392479E-04 3.2004386E-01 23 2.8748542E-01 -3.1744557E-06 1.0614772E-05 -1.0644387E-04 1.0993452E-01 24 1.2603693E-01 6.8954102E-07 -1.2879775E-06 -1.4465890E-05 1.2056727E-02 4f 5f 1 7.8705299E+03 5.0435821E-05 -2.5855841E-05 2 2.5020499E+03 4.5429787E-04 -2.3546501E-04 3 1.0299379E+03 2.7985368E-03 -1.4454388E-03 4 4.8369691E+02 1.3082858E-02 -6.8172471E-03 5 2.4699623E+02 4.5666406E-02 -2.3774508E-02 6 1.3263515E+02 1.2095733E-01 -6.3593468E-02 7 7.3889268E+01 2.3650466E-01 -1.2092680E-01 8 4.1894295E+01 3.2991496E-01 -1.5493765E-01 9 2.4098604E+01 3.0309019E-01 -8.1894557E-02 10 1.3870684E+01 1.6003100E-01 1.4651986E-01 11 7.8660404E+00 3.9793895E-02 3.6413875E-01 12 4.4199098E+00 2.8232476E-03 3.7980703E-01 13 2.4438504E+00 1.7951654E-04 2.1893829E-01 14 1.2954819E+00 -9.5006840E-05 6.4852471E-02 15 5.8728545E-01 1.1602864E-05 5.6647648E-03 16 2.2777031E-01 -5.2195681E-06 -5.1106940E-05 ** Uuo 294 ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2485475E+07 2.2730745E-03 -1.1011485E-03 5.4950912E-04 -2.9779002E-04 -1.6376073E-04 8.5294257E-05 -3.6524889E-05 2 1.3949578E+07 4.9508416E-03 -2.4151470E-03 1.2068398E-03 -6.5423933E-04 -3.5981746E-04 1.8741627E-04 -8.0256507E-05 3 4.7376592E+06 8.8056876E-03 -4.3294719E-03 2.1666330E-03 -1.1750092E-03 -6.4630614E-04 3.3664857E-04 -1.4416257E-04 4 1.7762539E+06 1.4121603E-02 -7.0273218E-03 3.5246656E-03 -1.9126266E-03 -1.0522160E-03 5.4811292E-04 -2.3472155E-04 5 7.2910086E+05 2.2067740E-02 -1.1133903E-02 5.5985697E-03 -3.0400203E-03 -1.6727759E-03 8.7141296E-04 -3.7317325E-04 6 3.1638078E+05 3.3372582E-02 -1.7153113E-02 8.6542464E-03 -4.7033630E-03 -2.5887286E-03 1.3486997E-03 -5.7758342E-04 7 1.4475290E+05 4.9893666E-02 -2.6165535E-02 1.3248453E-02 -7.2068488E-03 -3.9677125E-03 2.0672513E-03 -8.8530590E-04 8 6.8859125E+04 7.3068799E-02 -3.9230425E-02 1.9945320E-02 -1.0861366E-02 -5.9817693E-03 3.1170513E-03 -1.3349603E-03 9 3.4016068E+04 1.0430609E-01 -5.7284046E-02 2.9238548E-02 -1.5938163E-02 -8.7799957E-03 4.5752772E-03 -1.9594123E-03 10 1.7341712E+04 1.4188120E-01 -7.9584454E-02 4.0761179E-02 -2.2238869E-02 -1.2255498E-02 6.3876849E-03 -2.7359555E-03 11 9.1259270E+03 1.7683607E-01 -9.9794924E-02 5.1068966E-02 -2.7851669E-02 -1.5342601E-02 7.9943028E-03 -3.4232153E-03 12 4.9533506E+03 1.8919120E-01 -1.0120686E-01 5.0553177E-02 -2.7359874E-02 -1.5047166E-02 7.8402877E-03 -3.3591651E-03 13 2.8007487E+03 1.5500090E-01 -5.4807843E-02 2.0814516E-02 -1.0096572E-02 -5.3025316E-03 2.7114969E-03 -1.1501588E-03 14 1.7082851E+03 8.1779197E-02 3.2890292E-02 -3.6801235E-02 2.3672510E-02 1.3510244E-02 -7.0725249E-03 3.0068133E-03 15 1.2173349E+03 3.2568616E-02 8.3099524E-02 -7.1685895E-02 4.4654648E-02 2.6039722E-02 -1.3902143E-02 6.0493923E-03 16 8.6294330E+02 1.8916085E-02 2.0383522E-01 -1.8049776E-01 1.1409793E-01 6.5155428E-02 -3.4185981E-02 1.4577876E-02 17 5.6496658E+02 4.0243136E-03 3.1551670E-01 -3.0924097E-01 2.0221703E-01 1.1860720E-01 -6.3161266E-02 2.7298548E-02 18 3.5814007E+02 1.1017652E-04 2.9182748E-01 -3.1016032E-01 2.0806890E-01 1.2118227E-01 -6.3979343E-02 2.7332720E-02 19 2.2588018E+02 1.3899808E-04 1.3701982E-01 -2.6981164E-02 -9.4758501E-03 -7.8949477E-03 4.0547000E-03 -1.4629359E-03 20 1.4728989E+02 -1.7106106E-04 2.8326067E-02 3.6874424E-01 -4.2646863E-01 -3.0342874E-01 1.7195003E-01 -7.5618219E-02 21 9.8232993E+01 1.2274919E-04 3.5422710E-03 5.0877303E-01 -6.9052385E-01 -4.9869549E-01 2.7982121E-01 -1.2119996E-01 22 6.4461824E+01 -1.0875152E-04 6.7985632E-06 3.4529467E-01 -4.6175785E-01 -3.4779515E-01 2.0514445E-01 -9.1756269E-02 23 4.1057454E+01 9.1956383E-05 -4.8595079E-05 8.9566142E-02 3.0615867E-01 3.6695130E-01 -2.3690090E-01 1.0854771E-01 24 2.7263518E+01 -7.3112089E-05 -4.6988615E-05 6.2559664E-03 7.5822428E-01 1.0960411E+00 -7.9797510E-01 3.6834541E-01 25 1.8114011E+01 5.7574638E-05 -5.1251534E-05 1.1785198E-03 4.4898604E-01 7.5465510E-01 -5.3718123E-01 2.4961014E-01 26 1.2146042E+01 -3.5426105E-05 3.7984241E-05 -1.6462302E-04 1.1650911E-01 -3.7143507E-01 4.4218902E-01 -2.2252340E-01 27 7.4510075E+00 1.8244893E-05 -9.6377511E-06 -1.7459559E-04 1.0867987E-02 -1.0140367E+00 1.3046281E+00 -7.0678335E-01 28 4.4905823E+00 -1.3326756E-05 1.6946282E-05 3.4587254E-05 -4.9165096E-04 -4.3489515E-01 6.4042977E-01 -3.9015721E-01 29 2.9534760E+00 9.4750384E-06 -1.1910363E-05 -5.2221981E-05 5.1629465E-04 -3.3243243E-02 -5.7239015E-01 4.7141798E-01 30 1.8389254E+00 -5.1795601E-06 5.7317629E-06 4.2661338E-05 -2.8239996E-04 -1.2810068E-02 -7.9330016E-01 7.4290704E-01 31 1.1616649E+00 2.5468298E-06 -3.4666767E-06 -1.5893090E-05 8.3279967E-05 3.8921178E-03 -4.2305235E-01 5.1393915E-01 32 6.7542582E-01 -9.0969896E-07 1.1369872E-06 7.4803352E-06 -4.0132710E-05 -1.2097419E-03 -7.4256785E-02 -2.7153507E-01 33 3.6699516E-01 2.8796636E-07 -3.4129332E-07 -2.6039313E-06 1.2747451E-05 3.6949996E-04 -9.9438234E-04 -7.2308452E-01 34 1.8547942E-01 -7.7764831E-08 1.1873061E-07 4.6301838E-07 -1.9379579E-06 -9.2751468E-05 1.8872755E-05 -4.6670699E-01 35 8.1363389E-02 1.2377733E-08 -1.2484957E-08 -1.3921856E-07 6.9809613E-07 1.5472478E-05 1.3645637E-04 -6.5078900E-02 2p 3p 4p 5p 6p 7p 1 8.9585293E+07 7.4353147E-06 -4.1237432E-06 2.2890256E-06 1.2405721E-06 5.9682033E-07 -2.0677806E-07 2 3.9223111E+07 3.5936742E-05 -1.9919010E-05 1.1054056E-05 5.9898518E-06 2.8812748E-06 -9.9823287E-07 3 1.6859972E+07 8.1972577E-05 -4.5449323E-05 2.5225735E-05 1.3670747E-05 6.5765837E-06 -2.2785461E-06 4 7.4062471E+06 1.5686261E-04 -8.7012679E-05 4.8297590E-05 2.6172517E-05 1.2589851E-05 -4.3618324E-06 5 3.3227938E+06 2.8078845E-04 -1.5587973E-04 8.6548068E-05 4.6908916E-05 2.2567345E-05 -7.8188269E-06 6 1.5196355E+06 4.8962593E-04 -2.7213450E-04 1.5113005E-04 8.1908863E-05 3.9401983E-05 -1.3651121E-05 7 7.0672255E+05 8.4676764E-04 -4.7148158E-04 2.6199098E-04 1.4203659E-04 6.8338409E-05 -2.3677425E-05 8 3.3373675E+05 1.4702672E-03 -8.2083704E-04 4.5638857E-04 2.4743098E-04 1.1903404E-04 -4.1240724E-05 9 1.5992130E+05 2.5873121E-03 -1.4502111E-03 8.0730800E-04 4.3793133E-04 2.1074347E-04 -7.3019925E-05 10 7.7759426E+04 4.6592835E-03 -2.6263397E-03 1.4639593E-03 7.9424690E-04 3.8215903E-04 -1.3240722E-04 11 3.8369207E+04 8.6559445E-03 -4.9170798E-03 2.7471885E-03 1.4919384E-03 7.1821795E-04 -2.4887209E-04 12 1.9222219E+04 1.6621894E-02 -9.5381686E-03 5.3418754E-03 2.9020521E-03 1.3968164E-03 -4.8398665E-04 13 9.7905772E+03 3.2665191E-02 -1.8989336E-02 1.0675930E-02 5.8091243E-03 2.7981730E-03 -9.6972234E-04 14 5.0805793E+03 6.4004335E-02 -3.7833245E-02 2.1358045E-02 1.1629828E-02 5.6009864E-03 -1.9409142E-03 15 2.6924053E+03 1.1935935E-01 -7.2050611E-02 4.0932628E-02 2.2345616E-02 1.0774396E-02 -3.7346957E-03 16 1.4602384E+03 1.9841198E-01 -1.2263523E-01 7.0092623E-02 3.8300772E-02 1.8461264E-02 -6.3983372E-03 17 8.1177386E+02 2.6945860E-01 -1.6779128E-01 9.6120321E-02 5.2628942E-02 2.5406563E-02 -8.8090057E-03 18 4.6208098E+02 2.6487268E-01 -1.3773796E-01 7.1802335E-02 3.7832886E-02 1.8005447E-02 -6.2233733E-03 19 2.6846545E+02 1.6105981E-01 4.4589211E-02 -6.3123578E-02 -4.1380796E-02 -2.0845906E-02 7.2838017E-03 20 1.5944466E+02 4.7965600E-02 3.2084204E-01 -2.9932738E-01 -1.8933280E-01 -9.5321356E-02 3.3327567E-02 21 9.6709997E+01 5.5352170E-03 4.2271536E-01 -3.9432657E-01 -2.4496089E-01 -1.2181451E-01 4.2457632E-02 22 5.9030613E+01 -2.2357119E-06 2.5500696E-01 -9.6150867E-02 -2.6634235E-02 -9.7108076E-03 3.1848618E-03 23 3.6544258E+01 4.1191211E-05 6.3810438E-02 3.9792100E-01 4.0909922E-01 2.3781984E-01 -8.5597383E-02 24 2.3046393E+01 -1.4879751E-04 6.6840675E-03 5.3955542E-01 6.0080172E-01 3.4929960E-01 -1.2531808E-01 25 1.4323938E+01 8.7840118E-05 -3.6891243E-04 2.6423216E-01 6.1559084E-02 -1.7098973E-02 9.6852661E-03 26 8.7318867E+00 -4.7517716E-05 1.4178495E-04 4.3481677E-02 -5.8907224E-01 -5.2096154E-01 2.0332473E-01 27 5.3019785E+00 4.1380998E-05 -2.7331368E-04 2.7199111E-03 -5.4755586E-01 -5.2121202E-01 2.0789199E-01 28 3.1677771E+00 -2.3052678E-05 1.3368016E-04 -2.2516698E-04 -1.6605292E-01 1.1803822E-01 -7.6848218E-02 29 1.8575080E+00 1.2569114E-05 -7.0799137E-05 7.7808751E-05 -1.5310508E-02 6.1420188E-01 -3.3975980E-01 30 1.0630346E+00 -7.4000757E-06 4.5111461E-05 -1.1447765E-04 -5.7126651E-04 4.5750882E-01 -2.8320036E-01 31 5.8991389E-01 3.4956912E-06 -2.0867516E-05 4.9125907E-05 1.5677385E-04 1.1900860E-01 8.6580382E-02 32 3.1336096E-01 -1.7028469E-06 1.0228524E-05 -2.2862889E-05 4.5688240E-05 1.1574276E-02 4.0812899E-01 33 1.6045866E-01 7.5909203E-07 -4.6007170E-06 1.1253753E-05 1.0890701E-05 8.3201128E-04 4.5679746E-01 34 7.9367651E-02 -2.9167398E-07 1.7671867E-06 -4.2480476E-06 -2.0711241E-07 7.7077557E-05 2.4124964E-01 35 3.7533757E-02 7.2052148E-08 -4.3719376E-07 1.0594862E-06 1.5963567E-07 -7.4784577E-06 3.0848126E-02 3d 4d 5d 6d 1 1.7146515E+06 2.1445584E-06 -1.3188150E-06 7.0020774E-07 -2.8687239E-07 2 3.9002835E+05 1.0285786E-05 -6.3290610E-06 3.3627138E-06 -1.3791932E-06 3 1.1920657E+05 4.0974939E-05 -2.5246095E-05 1.3409303E-05 -5.4941645E-06 4 4.2898801E+04 1.4948085E-04 -9.2291735E-05 4.9088504E-05 -2.0138334E-05 5 1.7301116E+04 5.2564296E-04 -3.2549595E-04 1.7311134E-04 -7.0952402E-05 6 7.6240437E+03 1.8038200E-03 -1.1215408E-03 5.9772387E-04 -2.4532069E-04 7 3.6101516E+03 5.9492505E-03 -3.7181893E-03 1.9826104E-03 -8.1315755E-04 8 1.8111322E+03 1.8211271E-02 -1.1465094E-02 6.1316469E-03 -2.5185524E-03 9 9.5119131E+02 4.9784307E-02 -3.1689876E-02 1.6986087E-02 -6.9757345E-03 10 5.1908916E+02 1.1646180E-01 -7.5179954E-02 4.0495025E-02 -1.6662095E-02 11 2.9204020E+02 2.1878122E-01 -1.4119564E-01 7.5954000E-02 -3.1214817E-02 12 1.6811751E+02 3.0829382E-01 -1.9063041E-01 1.0131310E-01 -4.1560811E-02 13 9.8506390E+01 2.8727018E-01 -1.1378421E-01 4.5602520E-02 -1.6988145E-02 14 5.8153603E+01 1.5614355E-01 1.4312758E-01 -1.2632124E-01 5.7081439E-02 15 3.4346492E+01 3.9154183E-02 4.1294725E-01 -3.2318926E-01 1.4511144E-01 16 2.0516044E+01 2.8077950E-03 3.8835831E-01 -2.3779536E-01 9.4619758E-02 17 1.2203608E+01 1.7840129E-04 1.5949373E-01 2.0382717E-01 -1.3624655E-01 18 7.1058128E+00 -2.1142395E-04 2.3864299E-02 5.1649005E-01 -3.1522116E-01 19 4.0994313E+00 2.2053549E-05 8.6375796E-04 3.7066004E-01 -1.6375712E-01 20 2.3166074E+00 -3.7390153E-05 1.0866318E-04 1.0332247E-01 2.3674706E-01 21 1.2738921E+00 1.5078705E-05 -4.4612389E-05 8.4311779E-03 4.7612537E-01 22 6.7701115E-01 -7.1056792E-06 1.5997450E-05 2.9416858E-04 3.6224713E-01 23 3.4032476E-01 2.3266738E-06 -8.4798263E-07 -1.5824645E-04 1.3087788E-01 24 1.4828610E-01 -6.1990761E-07 1.9605045E-06 -1.9107425E-05 1.5279455E-02 4f 5f 1 8.1055050E+03 4.5131206E-05 -2.3466710E-05 2 2.5752043E+03 4.2334281E-04 -2.2208248E-04 3 1.0597230E+03 2.6689400E-03 -1.3961008E-03 4 4.9773588E+02 1.2640041E-02 -6.6686245E-03 5 2.5431382E+02 4.4499930E-02 -2.3458316E-02 6 1.3671263E+02 1.1862205E-01 -6.3144388E-02 7 7.6260821E+01 2.3351024E-01 -1.2096381E-01 8 4.3298291E+01 3.2820784E-01 -1.5633482E-01 9 2.4936486E+01 3.0411203E-01 -8.4511584E-02 10 1.4373377E+01 1.6199050E-01 1.4518298E-01 11 8.1719534E+00 4.0715323E-02 3.6475982E-01 12 4.6189096E+00 2.9561344E-03 3.7797816E-01 13 2.5863476E+00 1.9813134E-04 2.1685660E-01 14 1.3957268E+00 -1.0110575E-04 6.5510852E-02 15 6.3932727E-01 1.3040106E-05 5.8158148E-03 16 2.6314772E-01 -5.8467583E-06 -8.4996780E-05 Pseudo-large component functions -------------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2485475E+07 4.4948832E-05 -2.1686720E-05 1.0814025E-05 -5.8591464E-06 -3.2218547E-06 1.6780601E-06 -7.1857798E-07 2 1.3949578E+07 2.7642559E-04 -1.3339895E-04 6.6522172E-05 -3.6042839E-05 -1.9819601E-05 1.0322830E-05 -4.4204594E-06 3 4.7376592E+06 8.2768340E-04 -4.0004150E-04 1.9955027E-04 -1.0812849E-04 -5.9459748E-05 3.0969029E-05 -1.3261542E-05 4 1.7762539E+06 2.2215933E-03 -1.0751973E-03 5.3648571E-04 -2.9072278E-04 -1.5987398E-04 8.3270141E-05 -3.5658331E-05 5 7.2910086E+05 5.1125022E-03 -2.4789361E-03 1.2374188E-03 -6.7063533E-04 -3.6880051E-04 1.9208860E-04 -8.2255985E-05 6 3.1638078E+05 1.1207788E-02 -5.4453511E-03 2.7195493E-03 -1.4741025E-03 -8.1070776E-04 4.2226876E-04 -1.8082834E-04 7 1.4475290E+05 2.2512289E-02 -1.0969404E-02 5.4828246E-03 -2.9725714E-03 -1.6348574E-03 8.5153077E-04 -3.6464040E-04 8 6.8859125E+04 4.3042142E-02 -2.1053275E-02 1.0535656E-02 -5.7139685E-03 -3.1431132E-03 1.6372475E-03 -7.0114063E-04 9 3.4016068E+04 7.5565100E-02 -3.7163889E-02 1.8633269E-02 -1.0111116E-02 -5.5622259E-03 2.8973007E-03 -1.2406620E-03 10 1.7341712E+04 1.2238764E-01 -6.0552265E-02 3.0434179E-02 -1.6526401E-02 -9.0949306E-03 4.7383410E-03 -2.0293385E-03 11 9.1259270E+03 1.7279036E-01 -8.5409385E-02 4.2971957E-02 -2.3340790E-02 -1.2841573E-02 6.6888172E-03 -2.8639001E-03 12 4.9533506E+03 2.0457402E-01 -9.6342307E-02 4.7750561E-02 -2.5815898E-02 -1.4195813E-02 7.3957731E-03 -3.1686711E-03 13 2.8007487E+03 1.7629725E-01 -5.8621462E-02 2.4142167E-02 -1.2190845E-02 -6.5059830E-03 3.3487623E-03 -1.4242357E-03 14 1.7082851E+03 1.0232355E-01 2.3057199E-02 -2.8419138E-02 1.8447892E-02 1.0509777E-02 -5.4955387E-03 2.3304454E-03 15 1.2173349E+03 3.1956632E-02 8.0770783E-02 -6.6560637E-02 4.1082622E-02 2.3934205E-02 -1.2771507E-02 5.5608359E-03 16 8.6294330E+02 3.1093128E-02 1.9658871E-01 -1.6987847E-01 1.0678487E-01 6.0835024E-02 -3.1898477E-02 1.3595593E-02 17 5.6496658E+02 -1.0286061E-03 3.2096620E-01 -3.0456865E-01 1.9797929E-01 1.1595028E-01 -6.1714751E-02 2.6671365E-02 18 3.5814007E+02 5.4588284E-03 2.9740288E-01 -3.1052091E-01 2.0808633E-01 1.2116822E-01 -6.3976626E-02 2.7333601E-02 19 2.2588018E+02 -5.4280495E-03 1.4426360E-01 -3.4110346E-02 -2.5232145E-03 -3.3210710E-03 1.5498982E-03 -3.7957661E-04 20 1.4728989E+02 6.1216702E-03 2.6949399E-02 3.6741286E-01 -4.2065419E-01 -2.9853400E-01 1.6905602E-01 -7.4337841E-02 21 9.8232993E+01 -6.3155957E-03 6.2852528E-03 5.0993214E-01 -6.8836572E-01 -4.9666961E-01 2.7864212E-01 -1.2068715E-01 22 6.4461824E+01 5.8090234E-03 -2.3831773E-03 3.4941469E-01 -4.6480013E-01 -3.5008576E-01 2.0639564E-01 -9.2290074E-02 23 4.1057454E+01 -5.7613928E-03 2.3088494E-03 8.9410058E-02 3.0423243E-01 3.6332294E-01 -2.3421809E-01 1.0729128E-01 24 2.7263518E+01 5.8825176E-03 -2.4428762E-03 7.4604441E-03 7.5867175E-01 1.0948075E+00 -7.9673425E-01 3.6774621E-01 25 1.8114011E+01 -5.2965923E-03 2.0994050E-03 1.6095781E-04 4.5065883E-01 7.5601444E-01 -5.3822413E-01 2.5009447E-01 26 1.2146042E+01 3.9200070E-03 -1.5492969E-03 5.9419170E-04 1.1655528E-01 -3.7077693E-01 4.4105769E-01 -2.2190170E-01 27 7.4510075E+00 -2.6564329E-03 1.0633186E-03 -6.9038753E-04 1.1133334E-02 -1.0143229E+00 1.3042821E+00 -7.0651004E-01 28 4.4905823E+00 2.4107642E-03 -9.5498033E-04 5.0188086E-04 -7.0447843E-04 -4.3541797E-01 6.4090138E-01 -3.9043574E-01 29 2.9534760E+00 -2.1280010E-03 8.4487634E-04 -4.6426011E-04 7.0396145E-04 -3.3148750E-02 -5.7240667E-01 4.7130660E-01 30 1.8389254E+00 1.5102944E-03 -6.0161556E-04 3.3476500E-04 -4.1530253E-04 -1.2909585E-02 -7.9331813E-01 7.4283771E-01 31 1.1616649E+00 -9.3887950E-04 3.7374860E-04 -1.9723585E-04 1.6565921E-04 3.9496079E-03 -4.2317998E-01 5.1400397E-01 32 6.7542582E-01 4.5816452E-04 -1.8277371E-04 9.5863064E-05 -8.0257051E-05 -1.2369592E-03 -7.4249242E-02 -2.7152833E-01 33 3.6699516E-01 -2.0886289E-04 8.3435833E-05 -4.2849778E-05 3.1004086E-05 3.8168217E-04 -1.0043140E-03 -7.2309080E-01 34 1.8547942E-01 8.4358947E-05 -3.3698131E-05 1.6701584E-05 -9.2954107E-06 -9.7611435E-05 2.2784941E-05 -4.6671947E-01 35 8.1363389E-02 -2.4376927E-05 9.7547757E-06 -4.8280134E-06 2.8213802E-06 1.6864820E-05 1.3533760E-04 -6.5079732E-02 2p 3p 4p 5p 6p 7p 1 8.9585293E+07 4.9216991E-08 -2.7314351E-08 1.5174498E-08 8.2331034E-09 3.9643578E-09 -1.3738409E-09 2 3.9223111E+07 3.5933455E-07 -1.9951938E-07 1.1072847E-07 5.9969581E-08 2.8832322E-08 -9.9877349E-09 3 1.6859972E+07 1.3214162E-06 -7.3431867E-07 4.0795880E-07 2.2125166E-07 1.0649300E-07 -3.6900926E-08 4 7.4062471E+06 3.9637563E-06 -2.2050687E-06 1.2244652E-06 6.6333321E-07 3.1896213E-07 -1.1049455E-07 5 3.3227938E+06 1.0948536E-05 -6.1010555E-06 3.3919304E-06 1.8399238E-06 8.8562697E-07 -3.0688069E-07 6 1.5196355E+06 2.9098612E-05 -1.6248378E-05 9.0315931E-06 4.8941984E-06 2.3535781E-06 -8.1533933E-07 7 7.0672255E+05 7.6048035E-05 -4.2581208E-05 2.3702933E-05 1.2862079E-05 6.1915932E-06 -2.1455006E-06 8 3.3373675E+05 1.9748424E-04 -1.1092686E-04 6.1754852E-05 3.3481216E-05 1.6103314E-05 -5.5787762E-06 9 1.5992130E+05 5.1164029E-04 -2.8850753E-04 1.6089034E-04 8.7349152E-05 4.2053412E-05 -1.4572579E-05 10 7.7759426E+04 1.3225761E-03 -7.4906117E-04 4.1793295E-04 2.2674637E-04 1.0908195E-04 -3.7791774E-05 11 3.8369207E+04 3.3975095E-03 -1.9345979E-03 1.0815916E-03 5.8762472E-04 2.8295377E-04 -9.8053588E-05 12 1.9222219E+04 8.5902316E-03 -4.9242360E-03 2.7563688E-03 1.4969606E-03 7.2037560E-04 -2.4959240E-04 13 9.7905772E+03 2.1011157E-02 -1.2158167E-02 6.8269549E-03 3.7138120E-03 1.7888963E-03 -6.1995735E-04 14 5.0805793E+03 4.8442163E-02 -2.8417119E-02 1.6008125E-02 8.7104726E-03 4.1939361E-03 -1.4532466E-03 15 2.6924053E+03 1.0116101E-01 -6.0514548E-02 3.4299801E-02 1.8713122E-02 9.0217037E-03 -3.1270966E-03 16 1.4602384E+03 1.8104238E-01 -1.1092302E-01 6.3260590E-02 3.4544192E-02 1.6646917E-02 -5.7692515E-03 17 8.1177386E+02 2.5728643E-01 -1.5932407E-01 9.1204230E-02 4.9932064E-02 2.4104669E-02 -8.3576387E-03 18 4.6208098E+02 2.5879311E-01 -1.3529789E-01 7.0987262E-02 3.7504029E-02 1.7864023E-02 -6.1755442E-03 19 2.6846545E+02 1.5702053E-01 4.2293418E-02 -6.0028142E-02 -3.9330000E-02 -1.9805643E-02 6.9196877E-03 20 1.5944466E+02 4.3110252E-02 3.1874674E-01 -2.9553337E-01 -1.8666730E-01 -9.3946383E-02 3.2844728E-02 21 9.6709997E+01 3.2817580E-04 4.2376175E-01 -3.9386414E-01 -2.4460234E-01 -1.2163498E-01 4.2395101E-02 22 5.9030613E+01 -4.6489768E-03 2.5641091E-01 -9.8157665E-02 -2.8383411E-02 -1.0664918E-02 3.5235843E-03 23 3.6544258E+01 -3.9675533E-03 6.4364507E-02 3.9614804E-01 4.0692553E-01 2.3649476E-01 -8.5116604E-02 24 2.3046393E+01 -3.5905709E-03 6.6585371E-03 5.3950068E-01 6.0040694E-01 3.4907669E-01 -1.2523959E-01 25 1.4323938E+01 -3.2789584E-03 -3.1896761E-04 2.6402910E-01 6.2003933E-02 -1.6622050E-02 9.4968133E-03 26 8.7318867E+00 -2.8978189E-03 9.0613680E-05 4.3067161E-02 -5.8897741E-01 -5.2061143E-01 2.0317104E-01 27 5.3019785E+00 -2.7490391E-03 -2.4141642E-04 2.1342939E-03 -5.4786926E-01 -5.2133081E-01 2.0793307E-01 28 3.1677771E+00 -2.2568249E-03 1.0126839E-04 -6.3830402E-04 -1.6617482E-01 1.1785614E-01 -7.6750334E-02 29 1.8575080E+00 -2.4407053E-03 -5.3811316E-05 -4.2871247E-04 -1.5384221E-02 6.1410709E-01 -3.3969663E-01 30 1.0630346E+00 -1.6786067E-03 2.7097997E-05 -4.3028024E-04 -5.9552816E-04 4.5749124E-01 -2.8318844E-01 31 5.8991389E-01 -2.3011180E-03 -1.4576546E-05 -4.1690054E-04 1.0259253E-04 1.1893040E-01 8.6592596E-02 32 3.1336096E-01 -1.0563224E-03 1.5680831E-06 -2.2486838E-04 2.8615511E-05 1.1537161E-02 4.0813529E-01 33 1.6045866E-01 -2.4309541E-03 -4.4268548E-06 -4.7413151E-04 -4.1940203E-05 7.3841469E-04 4.5682043E-01 34 7.9367651E-02 3.1878342E-07 -7.7806741E-07 -1.6577860E-06 1.4923259E-06 7.7844705E-05 2.4125103E-01 35 3.7533757E-02 -2.8096745E-03 -4.3194063E-06 -5.5581469E-04 -5.8167934E-05 -1.1448766E-04 3.0872858E-02 3d 4d 5d 6d 1 1.7146515E+06 7.5239868E-08 -4.6302467E-08 2.4527431E-08 -1.0027889E-08 2 3.9002835E+05 8.6568767E-07 -5.3405218E-07 2.8450456E-07 -1.1689799E-07 3 1.1920657E+05 6.8422841E-06 -4.2232581E-06 2.2412424E-06 -9.1739174E-07 4 4.2898801E+04 4.3752157E-05 -2.7066266E-05 1.4415841E-05 -5.9186904E-06 5 1.7301116E+04 2.3650326E-04 -1.4651005E-04 7.7889798E-05 -3.1913413E-05 6 7.6240437E+03 1.0995112E-03 -6.8324088E-04 3.6416928E-04 -1.4948626E-04 7 3.6101516E+03 4.4238836E-03 -2.7599043E-03 1.4706754E-03 -6.0305979E-04 8 1.8111322E+03 1.5328491E-02 -9.6286643E-03 5.1467319E-03 -2.1137863E-03 9 9.5119131E+02 4.5144825E-02 -2.8663499E-02 1.5352369E-02 -6.3036000E-03 10 5.1908916E+02 1.1040212E-01 -7.1113838E-02 3.8284118E-02 -1.5750467E-02 11 2.9204020E+02 2.1276422E-01 -1.3710535E-01 7.3724362E-02 -3.0295645E-02 12 1.6811751E+02 3.0424863E-01 -1.8810716E-01 9.9995924E-02 -4.1023644E-02 13 9.8506390E+01 2.8565196E-01 -1.1379488E-01 4.5895672E-02 -1.7141385E-02 14 5.8153603E+01 1.5538972E-01 1.4173539E-01 -1.2508255E-01 5.6517208E-02 15 3.4346492E+01 3.8475711E-02 4.1193093E-01 -3.2218762E-01 1.4464694E-01 16 2.0516044E+01 2.1945655E-03 3.8826724E-01 -2.3791605E-01 9.4726635E-02 17 1.2203608E+01 -2.3779287E-04 1.5941647E-01 2.0335989E-01 -1.3593582E-01 18 7.1058128E+00 -5.1989201E-04 2.3732079E-02 5.1626086E-01 -3.1503973E-01 19 4.0994313E+00 -1.6719555E-04 7.2445879E-04 3.7064303E-01 -1.6379065E-01 20 2.3166074E+00 -1.8290322E-04 3.0196723E-05 1.0326553E-01 2.3668250E-01 21 1.2738921E+00 -6.8031999E-05 -1.0756537E-04 8.3883443E-03 4.7609356E-01 22 6.7701115E-01 -7.6066155E-05 -2.1865928E-05 2.5115021E-04 3.6224054E-01 23 3.4032476E-01 -2.9616904E-05 -2.4500903E-05 -1.7599015E-04 1.3087228E-01 24 1.4828610E-01 -3.9481244E-05 -2.1606333E-05 -4.2584820E-05 1.5270530E-02 4f 5f 1 8.1055050E+03 2.4162919E-05 -1.2526861E-05 2 2.5752043E+03 3.1909780E-04 -1.6748049E-04 3 1.0597230E+03 2.3210476E-03 -1.2130911E-03 4 4.9773588E+02 1.1773023E-02 -6.2086318E-03 5 2.5431382E+02 4.2900156E-02 -2.2602816E-02 6 1.3671263E+02 1.1642235E-01 -6.1951782E-02 7 7.6260821E+01 2.3134931E-01 -1.1983139E-01 8 4.3298291E+01 3.2674408E-01 -1.5566825E-01 9 2.4936486E+01 3.0353601E-01 -8.4527038E-02 10 1.4373377E+01 1.6180281E-01 1.4479989E-01 11 8.1719534E+00 4.0615219E-02 3.6445036E-01 12 4.6189096E+00 2.8845141E-03 3.7785217E-01 13 2.5863476E+00 1.6526819E-04 2.1681806E-01 14 1.3957268E+00 -1.2164367E-04 6.5488909E-02 15 6.3932727E-01 4.7779462E-06 5.8023819E-03 16 2.6314772E-01 -9.7889040E-06 -9.0835338E-05 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 7s 1 5.2485475E+07 5.3807922E-03 -2.6203321E-03 1.3054044E-03 -7.0712564E-04 -3.8877558E-04 2.0249043E-04 -8.6707851E-05 2 1.3949578E+07 1.0850381E-02 -5.3036769E-03 2.6443219E-03 -1.4327137E-03 -7.8775771E-04 4.1030619E-04 -1.7569712E-04 3 4.7376592E+06 1.7685978E-02 -8.6848509E-03 4.3342611E-03 -2.3489703E-03 -1.2916369E-03 6.7276424E-04 -2.8808768E-04 4 1.7762539E+06 2.6368645E-02 -1.3051546E-02 6.5232457E-03 -3.5367202E-03 -1.9450325E-03 1.0131238E-03 -4.3382255E-04 5 7.2910086E+05 3.8108762E-02 -1.9057259E-02 9.5439399E-03 -5.1772937E-03 -2.8476887E-03 1.4833306E-03 -6.3516748E-04 6 3.1638078E+05 5.3407001E-02 -2.7119273E-02 1.3620706E-02 -7.3940401E-03 -4.0687583E-03 2.1202427E-03 -9.0808509E-04 7 1.4475290E+05 7.3837335E-02 -3.8209365E-02 1.9262593E-02 -1.0465220E-02 -5.7579499E-03 2.9996269E-03 -1.2845319E-03 8 6.8859125E+04 1.0009633E-01 -5.3064402E-02 2.6880679E-02 -1.4616959E-02 -8.0405101E-03 4.1871943E-03 -1.7929288E-03 9 3.4016068E+04 1.3276834E-01 -7.2246482E-02 3.6815296E-02 -2.0073516E-02 -1.1060403E-02 5.7644075E-03 -2.4687430E-03 10 1.7341712E+04 1.6902277E-01 -9.4356400E-02 4.8342218E-02 -2.6410347E-02 -1.4566841E-02 7.5941635E-03 -3.2527524E-03 11 9.1259270E+03 1.9906715E-01 -1.1236307E-01 5.7540456E-02 -3.1386901E-02 -1.7293485E-02 9.0117884E-03 -3.8588290E-03 12 4.9533506E+03 2.0302711E-01 -1.0875490E-01 5.4312142E-02 -2.9364139E-02 -1.6147643E-02 8.4130474E-03 -3.6046185E-03 13 2.8007487E+03 1.5908020E-01 -5.5334321E-02 2.0761625E-02 -9.9929803E-03 -5.2359727E-03 2.6790162E-03 -1.1362084E-03 14 1.7082851E+03 7.9040983E-02 3.7813462E-02 -4.0140533E-02 2.5699207E-02 1.4662667E-02 -7.6836367E-03 3.2662144E-03 15 1.2173349E+03 2.8776620E-02 8.6344849E-02 -7.3675230E-02 4.5827876E-02 2.6715346E-02 -1.4254505E-02 6.2066173E-03 16 8.6294330E+02 1.7412307E-02 2.1215476E-01 -1.8784524E-01 1.1885764E-01 6.7906608E-02 -3.5643304E-02 1.5196655E-02 17 5.6496658E+02 2.9819336E-03 3.2134259E-01 -3.1609204E-01 2.0697766E-01 1.2146159E-01 -6.4698233E-02 2.7970697E-02 18 3.5814007E+02 -1.9564627E-04 2.9247317E-01 -3.1238122E-01 2.1003870E-01 1.2239760E-01 -6.4625397E-02 2.7602044E-02 19 2.2588018E+02 -9.2640423E-05 1.3459547E-01 -2.2838163E-02 -1.2371818E-02 -9.5174110E-03 4.8874935E-03 -1.8080345E-03 20 1.4728989E+02 -2.3388880E-04 2.7059530E-02 3.7376105E-01 -4.3190859E-01 -3.0741432E-01 1.7424878E-01 -7.6638394E-02 21 9.8232993E+01 2.3840190E-05 3.0827189E-03 5.1054544E-01 -6.9376264E-01 -5.0107669E-01 2.8112233E-01 -1.2175093E-01 22 6.4461824E+01 -1.1355779E-04 -2.8761306E-05 3.4457785E-01 -4.6094391E-01 -3.4755347E-01 2.0516608E-01 -9.1798331E-02 23 4.1057454E+01 5.3904552E-05 -1.4015196E-04 8.8774573E-02 3.0891453E-01 3.6956738E-01 -2.3853794E-01 1.0929218E-01 24 2.7263518E+01 -6.2033469E-05 -1.8393177E-05 5.9971123E-03 7.5947978E-01 1.0982464E+00 -7.9973140E-01 3.6916675E-01 25 1.8114011E+01 4.1503118E-05 -1.0045572E-04 1.1563591E-03 4.4851078E-01 7.5422032E-01 -5.3687020E-01 2.4947456E-01 26 1.2146042E+01 -2.9011578E-05 4.9374331E-05 -1.8387934E-04 1.1623556E-01 -3.7264393E-01 4.4324553E-01 -2.2302686E-01 27 7.4510075E+00 1.3739513E-05 -2.5985286E-05 -1.7397588E-04 1.0804521E-02 -1.0143798E+00 1.3051930E+00 -7.0712322E-01 28 4.4905823E+00 -1.0996928E-05 2.3301410E-05 2.8473497E-05 -5.1540856E-04 -4.3472711E-01 6.4021265E-01 -3.9005724E-01 29 2.9534760E+00 7.2376970E-06 -1.7734929E-05 -5.0244208E-05 5.0289079E-04 -3.3172137E-02 -5.7267101E-01 4.7162518E-01 30 1.8389254E+00 -4.3617971E-06 8.1400597E-06 3.9219243E-05 -2.8014712E-04 -1.2817761E-02 -7.9331066E-01 7.4294162E-01 31 1.1616649E+00 1.8931401E-06 -5.0311464E-06 -1.6999237E-05 8.1096077E-05 3.9011511E-03 -4.2303302E-01 5.1392840E-01 32 6.7542582E-01 -7.5277390E-07 1.5305116E-06 6.6246594E-06 -3.7409778E-05 -1.2058132E-03 -7.4243327E-02 -2.7157389E-01 33 3.6699516E-01 2.1712335E-07 -7.5039104E-07 -2.5368536E-06 1.1840890E-05 3.6826708E-04 -9.9067816E-04 -7.2309346E-01 34 1.8547942E-01 -6.2920640E-08 2.7817576E-08 6.5472354E-07 -2.2300366E-06 -9.2446303E-05 1.9090184E-05 -4.6670363E-01 35 8.1363389E-02 4.6957687E-09 -4.0978239E-08 -1.9113261E-07 7.2245878E-07 1.5598612E-05 1.3651628E-04 -6.5077590E-02 2p 3p 4p 5p 6p 7p 1 8.9585293E+07 3.1393801E-06 -1.7446247E-06 9.7592676E-07 5.3131104E-07 2.5645066E-07 -8.8925806E-08 2 3.9223111E+07 3.1293863E-05 -1.7300922E-05 9.6023412E-06 5.1984339E-06 2.4984461E-06 -8.6538956E-07 3 1.6859972E+07 7.5958043E-05 -4.2055284E-05 2.3374753E-05 1.2681463E-05 6.1060442E-06 -2.1160056E-06 4 7.4062471E+06 1.5156068E-04 -8.3949983E-05 4.6611497E-05 2.5241247E-05 1.2133479E-05 -4.2028860E-06 5 3.3227938E+06 2.8274854E-04 -1.5700557E-04 8.7317808E-05 4.7377611E-05 2.2811473E-05 -7.9050730E-06 6 1.5196355E+06 5.1373363E-04 -2.8568447E-04 1.5877129E-04 8.6010200E-05 4.1351342E-05 -1.4324098E-05 7 7.0672255E+05 9.2370166E-04 -5.1538111E-04 2.8692536E-04 1.5571935E-04 7.4976699E-05 -2.5982280E-05 8 3.3373675E+05 1.6583880E-03 -9.2791651E-04 5.1646231E-04 2.7993467E-04 1.3461363E-04 -4.6632483E-05 9 1.5992130E+05 2.9899616E-03 -1.6811122E-03 9.3753880E-04 5.0903843E-04 2.4510740E-04 -8.4939381E-05 10 7.7759426E+04 5.4455411E-03 -3.0779008E-03 1.7174047E-03 9.3167832E-04 4.4815644E-04 -1.5525945E-04 11 3.8369207E+04 1.0081656E-02 -5.7425971E-03 3.2127170E-03 1.7458684E-03 8.4079960E-04 -2.9137788E-04 12 1.9222219E+04 1.9036817E-02 -1.0945912E-02 6.1346883E-03 3.3327666E-03 1.6038681E-03 -5.5570057E-04 13 9.7905772E+03 3.6487027E-02 -2.1250080E-02 1.1957063E-02 6.5087336E-03 3.1359274E-03 -1.0868431E-03 14 5.0805793E+03 6.9596289E-02 -4.1208531E-02 2.3277587E-02 1.2675900E-02 6.1043278E-03 -2.1152784E-03 15 2.6924053E+03 1.2664412E-01 -7.6606297E-02 4.3556377E-02 2.3785339E-02 1.1470324E-02 -3.9760642E-03 16 1.4602384E+03 2.0623642E-01 -1.2780676E-01 7.3118950E-02 3.9963928E-02 1.9263151E-02 -6.6762194E-03 17 8.1177386E+02 2.7542263E-01 -1.7207338E-01 9.8707671E-02 5.4072683E-02 2.6109058E-02 -9.0530527E-03 18 4.6208098E+02 2.6696036E-01 -1.3895242E-01 7.2470760E-02 3.8185842E-02 1.8171307E-02 -6.2804459E-03 19 2.6846545E+02 1.6033604E-01 4.6894975E-02 -6.4919255E-02 -4.2448841E-02 -2.1369739E-02 7.4658048E-03 20 1.5944466E+02 4.7065091E-02 3.2418624E-01 -3.0243281E-01 -1.9133761E-01 -9.6340999E-02 3.3685011E-02 21 9.6709997E+01 5.2881102E-03 4.2394786E-01 -3.9575056E-01 -2.4589124E-01 -1.2227788E-01 4.2618916E-02 22 5.9030613E+01 -5.1727461E-05 2.5462689E-01 -9.5228133E-02 -2.5977581E-02 -9.3881658E-03 3.0732689E-03 23 3.6544258E+01 3.5565170E-05 6.3422513E-02 3.9934362E-01 4.1047849E-01 2.3863673E-01 -8.5893078E-02 24 2.3046393E+01 -1.5671490E-04 6.6122759E-03 5.3991023E-01 6.0137655E-01 3.4964883E-01 -1.2544356E-01 25 1.4323938E+01 8.8788223E-05 -3.8746595E-04 2.6401743E-01 6.1013223E-02 -1.7470247E-02 9.8209906E-03 26 8.7318867E+00 -4.9556582E-05 1.4330679E-04 4.3380514E-02 -5.8948700E-01 -5.2132059E-01 2.0346691E-01 27 5.3019785E+00 4.2144349E-05 -2.7738714E-04 2.7053884E-03 -5.4756484E-01 -5.2125324E-01 2.0791184E-01 28 3.1677771E+00 -2.3546842E-05 1.3446663E-04 -2.2792212E-04 -1.6598835E-01 1.1817553E-01 -7.6909940E-02 29 1.8575080E+00 1.2807365E-05 -7.1875339E-05 7.7593996E-05 -1.5299705E-02 6.1426293E-01 -3.3979600E-01 30 1.0630346E+00 -7.5632255E-06 4.5480031E-05 -1.1490547E-04 -5.6869050E-04 4.5750266E-01 -2.8320063E-01 31 5.8991389E-01 3.5485612E-06 -2.1062281E-05 4.9102571E-05 1.5662842E-04 1.1899952E-01 8.6592744E-02 32 3.1336096E-01 -1.7383915E-06 1.0309409E-05 -2.2914399E-05 4.5996179E-05 1.1573204E-02 4.0813482E-01 33 1.6045866E-01 7.7351025E-07 -4.6448604E-06 1.1259842E-05 1.0818713E-05 8.3169636E-04 4.5679851E-01 34 7.9367651E-02 -2.9745894E-07 1.7816563E-06 -4.2558850E-06 -1.6452289E-07 7.7090282E-05 2.4124895E-01 35 3.7533757E-02 7.3272398E-08 -4.4132568E-07 1.0602656E-06 1.5490132E-07 -7.4948010E-06 3.0847905E-02 3d 4d 5d 6d 1 1.7146515E+06 2.2608961E-06 -1.3842633E-06 7.3226187E-07 -2.9919102E-07 2 3.9002835E+05 1.1262732E-05 -6.9324443E-06 3.6913402E-06 -1.5169392E-06 3 1.1920657E+05 4.6327220E-05 -2.8483105E-05 1.5099059E-05 -6.1772064E-06 4 4.2898801E+04 1.7143188E-04 -1.0589904E-04 5.6391578E-05 -2.3156702E-05 5 1.7301116E+04 5.9531465E-04 -3.6837860E-04 1.9577157E-04 -8.0190842E-05 6 7.6240437E+03 1.9918291E-03 -1.2386473E-03 6.6041897E-04 -2.7115002E-04 7 3.6101516E+03 6.3931486E-03 -3.9949440E-03 2.1297239E-03 -8.7332001E-04 8 1.8111322E+03 1.9145094E-02 -1.2054947E-02 6.4482445E-03 -2.6489327E-03 9 9.5119131E+02 5.1478724E-02 -3.2778508E-02 1.7570610E-02 -7.2155714E-03 10 5.1908916E+02 1.1900988E-01 -7.6867301E-02 4.1412265E-02 -1.7040780E-02 11 2.9204020E+02 2.2164585E-01 -1.4312916E-01 7.7008780E-02 -3.1649227E-02 12 1.6811751E+02 3.1042421E-01 -1.9207071E-01 1.0210648E-01 -4.1889839E-02 13 9.8506390E+01 2.8792465E-01 -1.1384821E-01 4.5547281E-02 -1.6954550E-02 14 5.8153603E+01 1.5600370E-01 1.4408248E-01 -1.2701353E-01 5.7384762E-02 15 3.4346492E+01 3.8999942E-02 4.1381118E-01 -3.2390816E-01 1.4544314E-01 16 2.0516044E+01 2.7797793E-03 3.8850295E-01 -2.3783352E-01 9.4619287E-02 17 1.2203608E+01 1.7469799E-04 1.5940322E-01 2.0418273E-01 -1.3644308E-01 18 7.1058128E+00 -2.1123020E-04 2.3827768E-02 5.1668202E-01 -3.1534742E-01 19 4.0994313E+00 2.1589846E-05 8.6048287E-04 3.7065888E-01 -1.6374001E-01 20 2.3166074E+00 -3.7225790E-05 1.0777677E-04 1.0330208E-01 2.3680455E-01 21 1.2738921E+00 1.4941771E-05 -4.4392084E-05 8.4274399E-03 4.7615134E-01 22 6.7701115E-01 -7.0543389E-06 1.5851117E-05 2.9393733E-04 3.6224831E-01 23 3.4032476E-01 2.3094034E-06 -8.0891371E-07 -1.5830090E-04 1.3087603E-01 24 1.4828610E-01 -6.1600705E-07 1.9496112E-06 -1.9106127E-05 1.5279095E-02 4f 5f 1 8.1055050E+03 5.0337319E-05 -2.6130466E-05 2 2.5752043E+03 4.5093058E-04 -2.3663817E-04 3 1.0597230E+03 2.7695922E-03 -1.4484698E-03 4 4.9773588E+02 1.2928793E-02 -6.8215517E-03 5 2.5431382E+02 4.5110130E-02 -2.3780933E-02 6 1.3671263E+02 1.1957180E-01 -6.3660084E-02 7 7.6260821E+01 2.3454812E-01 -1.2150901E-01 8 4.3298291E+01 3.2894051E-01 -1.5669340E-01 9 2.4936486E+01 3.0437435E-01 -8.4530586E-02 10 1.4373377E+01 1.6198848E-01 1.4541083E-01 11 8.1719534E+00 4.0692547E-02 3.6494410E-01 12 4.6189096E+00 2.9513083E-03 3.7804303E-01 13 2.5863476E+00 1.9817934E-04 2.1685912E-01 14 1.3957268E+00 -1.0123485E-04 6.5507347E-02 15 6.3932727E-01 1.3071189E-05 5.8151223E-03 16 2.6314772E-01 -5.8527848E-06 -8.5047675E-05 Exponents of diffuse functions ============================== s p d f g Uut 1.0224241E-02 3.5943639E-03 2.7510906E-02 6.7027914E-02 2.0557281E-01 Uuq 1.4221546E-02 6.5499500E-03 3.0485093E-02 5.2193098E-02 1.8474569E-01 Uup 1.8164462E-02 9.1411501E-03 2.4503445E-02 5.8539994E-02 1.9302050E-01 Uuh 1.9856461E-02 1.1474289E-02 3.8617137E-02 8.0300071E-02 2.0535574E-01 Uus 2.3158456E-02 1.3960017E-02 4.8651229E-02 1.0529897E-01 2.2128313E-01 Uuo 2.7009550E-02 1.6984239E-02 5.7239579E-02 1.2165406E-01 2.2342465E-01 Exponents of correlating functions ================================== 7s7p valence correlating functions ---------------------------------- d d d f f g Uut 4.3318267E-01 2.0988029E-01 9.3438434E-02 3.7354701E-01 2.5143349E-01 4.4043963E-01 Uuq 4.8606519E-01 2.3901036E-01 1.0633467E-01 4.2886320E-01 1.6496259E-01 4.4156220E-01 Uup 5.1139672E-01 2.5468564E-01 1.1303759E-01 4.8241565E-01 1.7263001E-01 4.3508997E-01 Uuh 5.7122110E-01 2.8647155E-01 1.2659727E-01 5.3507461E-01 2.0355074E-01 4.4981326E-01 Uus 5.6984084E-01 2.8748542E-01 1.2603693E-01 5.8728545E-01 2.2777031E-01 4.5412158E-01 Uuo 6.7701115E-01 3.4032476E-01 1.4828610E-01 6.3932727E-01 2.6314772E-01 4.5851646E-01 6d core correlating functions ----------------------------- f f f g g h Uut 1.8463768E+00 8.8758782E-01 3.7354701E-01 1.5610803E+00 6.4807671E-01 1.2031165E+00 Uuq 2.0031370E+00 9.9243102E-01 4.2886320E-01 1.6851242E+00 7.2132204E-01 1.3153248E+00 Uup 2.1533604E+00 1.0944519E+00 4.8241565E-01 1.8071813E+00 7.9275300E-01 1.4255639E+00 Uuh 2.2998596E+00 1.1952368E+00 5.3507461E-01 1.9286737E+00 8.6323540E-01 1.5346977E+00 Uus 2.4438504E+00 1.2954819E+00 5.8728545E-01 2.0505005E+00 9.3330217E-01 1.6432068E+00 Uuo 2.5863476E+00 1.3957268E+00 6.3932727E-01 2.1733066E+00 1.0033326E+00 1.7514978E+00 5f core correlating functions ----------------------------- g g g h h i Uut 1.3092328E+01 5.8975083E+00 2.5692386E+00 8.8521723E+00 3.9892272E+00 7.1897585E+00 Uuq 1.3818732E+01 6.2431299E+00 2.7354912E+00 9.2219632E+00 4.1949997E+00 7.5208812E+00 Uup 1.4591527E+01 6.6049480E+00 2.9086723E+00 9.5964269E+00 4.4047080E+00 7.8572631E+00 Uuh 1.5409179E+01 6.9809375E+00 3.0874158E+00 9.9750222E+00 4.6176534E+00 8.1983896E+00 Uus 1.6277005E+01 7.3717724E+00 3.2717579E+00 1.0357713E+01 4.8337525E+00 8.5442395E+00 Uuo 1.7201530E+01 7.7783167E+00 3.4618300E+00 1.0744572E+01 5.0529837E+00 8.8948726E+00 4f core correlating functions ----------------------------- g g g h h i Uut 1.4709485E+02 5.3773260E+01 2.2026200E+01 8.1751169E+01 3.2996760E+01 5.5964878E+01 Uuq 1.5034501E+02 5.5120103E+01 2.2624490E+01 8.3947678E+01 3.3925107E+01 5.7489816E+01 Uup 1.5363774E+02 5.6484337E+01 2.3231071E+01 8.6173250E+01 3.4866081E+01 5.9034777E+01 Uuh 1.5697417E+02 5.7866105E+01 2.3845702E+01 8.8427441E+01 3.5819366E+01 6.0599555E+01 Uus 1.6035302E+02 5.9264690E+01 2.4468164E+01 9.0710036E+01 3.6784870E+01 6.2183919E+01 Uuo 1.6377306E+02 6.0680447E+01 2.5098593E+01 9.3021423E+01 3.7762731E+01 6.3788159E+01 3d core correlating functions ----------------------------- g g h Uut 3.7914653E+02 1.4709485E+02 2.7049315E+02 Uuq 3.8765248E+02 1.5034501E+02 2.7670315E+02 Uup 3.9627687E+02 1.5363774E+02 2.8299153E+02 Uuh 4.0502677E+02 1.5697417E+02 2.8934630E+02 Uus 4.1389261E+02 1.6035302E+02 2.9578467E+02 Uuo 4.2288434E+02 1.6377306E+02 3.0229678E+02 2p core correlating functions ----------------------------- g Uut 1.7826602E+03 Uuq 1.8419553E+03 Uup 1.9006344E+03 Uuh 1.9615207E+03 Uus 2.0199126E+03 Uuo 2.0839895E+03 1s core correlating functions ----------------------------- f Uut 3.3501927E+04 Uuq 3.5080807E+04 Uup 3.6775494E+04 Uuh 3.8578172E+04 Uus 4.0529498E+04 Uuo 4.2479972E+04