5d-Block Double-Zeta Basis Set Archive ====================================== Title: Relativistic finite nucleus double-, triple-, and quadruple-zeta basis sets for the 5d elements Hf-Hg. Ref: Theor. Chem. Acc. 112, 403-409 (2004). Author: Kenneth G. Dyall Date: 23 Jun 2003 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. The contractions are taken from SCF calculations on the configuration average of the d^n s^2 and d^n+1 s^1 configurations. 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 have a "-" label for j=l-1/2 and a "+" label 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 valence correlating functions. 4. Exponents of core correlating functions. Basis set construction. ---------------------- Contracted basis sets can be constructed by adding primitive functions to the SCF set. These basis sets are described below. Note that the term "double zeta" applies to the s and p set, and the d set is triple zeta. This is a result of keeping a reasonable energy balance for the basis sets. Functions are counted in increasing exponent size, from the smallest. 1. Valence. The valence space is defined here as the 5d and 6s orbitals. To the SCF functions, add the 2nd s primitive, the 1st and 2nd primitives from the p and d sets, and the valence correlating f function. (HF + 1s2p2d1f valence) 2. Valence + outer core. This set adds the outer-core correlation from the 5s and 5p shells. To set 1, add the 4th s primitive, the 3rd p primitive and the 3rd d primitive. If linear dependence problems are encountered in the d space, delete the 5d orbital and optionally also delete the 6s orbital and add the 1st s primitive, or do not add the 3rd d primitive (on the grounds that the 5d orbital will be used to correlate the 5s and 5p). Note: excitations into the 5d shell were not considered in the determination of the exponents to uncontract. (HF + 1s2p2d1f valence + 1s1p1d outer core) 3. Valence + outer core + 4f. This set adds correlation from the 4f shell. To set 2, add the 2nd and 3rd f primitives, the 4th d primitive, and the core correlating g function. This choice reflects only 4f correlation with a change in angular momentum of 1 unit. If it is necessary to uncontract an s and p primitive, add the 5th s and p primitives to the set. (HF + 1s2p2d1f valence + 1s1p1d outer core + 1d2f1g core) 4. Dipole polarization of the 5d. To any of the above basis sets, add the polarizing f function listed at the end of this archive. Dirac-Hartree-Fock basis sets ============================= ** Hf ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.8655750E+07 1.7791176E-04 6.6963329E-05 3.1663930E-05 1.5461556E-05 6.0949213E-06 1.6698743E-06 2 1.0162738E+07 5.1153312E-04 1.9328103E-04 9.1494503E-05 4.4672868E-05 1.7609971E-05 4.8248206E-06 3 2.6555530E+06 1.2873252E-03 4.8966670E-04 2.3187495E-04 1.1328165E-04 4.4660071E-05 1.2235957E-05 4 7.7479033E+05 3.0661334E-03 1.1760215E-03 5.5818677E-04 2.7264838E-04 1.0748867E-04 2.9450706E-05 5 2.4763412E+05 7.2414729E-03 2.8149974E-03 1.3369045E-03 6.5380979E-04 2.5781196E-04 7.0636190E-05 6 8.5154884E+04 1.7103645E-02 6.7403111E-03 3.2149393E-03 1.5714103E-03 6.1962274E-04 1.6977755E-04 7 3.1200957E+04 4.0092999E-02 1.6179296E-02 7.7225730E-03 3.7836119E-03 1.4925226E-03 4.0893504E-04 8 1.2078618E+04 9.0706994E-02 3.7719911E-02 1.8171998E-02 8.8956286E-03 3.5090035E-03 9.6155964E-04 9 4.9069917E+03 1.8605523E-01 8.2945473E-02 4.0193231E-02 1.9787426E-02 7.8135143E-03 2.1409949E-03 10 2.0797575E+03 3.0850173E-01 1.5491325E-01 7.7398675E-02 3.8140759E-02 1.5069417E-02 4.1306964E-03 11 9.1548773E+02 3.2622846E-01 2.0510685E-01 1.0517080E-01 5.2781618E-02 2.0927409E-02 5.7361401E-03 12 4.1721154E+02 1.4539224E-01 2.3294878E-02 7.2275179E-03 1.9140083E-03 6.2047572E-04 1.7001803E-04 13 1.8530823E+02 1.1557232E-02 -4.8883641E-01 -4.1287825E-01 -2.2871982E-01 -9.2806511E-02 -2.5538985E-02 14 8.6777652E+01 1.0752603E-04 -5.5560585E-01 -6.0431436E-01 -3.7620364E-01 -1.5695690E-01 -4.3302739E-02 15 3.5694466E+01 -2.7048185E-04 -1.0294759E-01 4.4365902E-01 4.3859314E-01 2.0261533E-01 5.6625918E-02 16 1.8543018E+01 1.6067995E-04 1.6633032E-02 8.3035930E-01 1.0042236E+00 4.9109691E-01 1.3870228E-01 17 7.4692683E+00 -8.4070218E-05 -5.8020521E-03 1.1975856E-01 -5.9515344E-01 -4.2715052E-01 -1.2647854E-01 18 3.6765607E+00 4.6368341E-05 2.7180426E-03 -1.4721394E-02 -8.7403045E-01 -8.0116029E-01 -2.5125669E-01 19 1.0677454E+00 -1.6169907E-05 -8.8236627E-04 4.0369945E-03 -6.0872607E-02 7.0078274E-01 2.8201729E-01 20 4.8782008E-01 7.8307159E-06 4.2666288E-04 -1.9272802E-03 1.4171642E-02 6.4810934E-01 4.2344054E-01 21 9.1800954E-02 -2.0333649E-06 -1.0944191E-04 4.6968024E-04 -2.8808902E-03 3.0498586E-02 -6.2215043E-01 22 3.5802468E-02 8.9655892E-07 4.8278738E-05 -2.0500842E-04 1.2514651E-03 -5.5345255E-03 -5.6874220E-01 2p- 3p- 4p- 5p- 1 4.0818814E+06 2.5336842E-04 1.2656121E-04 6.1033963E-05 2.2005836E-05 2 6.0219881E+05 7.7530953E-04 3.8740549E-04 1.8684204E-04 6.7376149E-05 3 1.2441686E+05 2.1147883E-03 1.0584091E-03 5.1063163E-04 1.8408519E-04 4 3.1579943E+04 5.5620659E-03 2.7915048E-03 1.3477338E-03 4.8632913E-04 5 9.4564371E+03 1.5098335E-02 7.6484166E-03 3.6999520E-03 1.3335187E-03 6 3.2577399E+03 4.2642750E-02 2.1879020E-02 1.0618094E-02 3.8398940E-03 7 1.2563399E+03 1.1550202E-01 6.1222565E-02 2.9925314E-02 1.0794607E-02 8 5.2805546E+02 2.5917125E-01 1.4323604E-01 7.0769845E-02 2.5735997E-02 9 2.3611837E+02 3.9434788E-01 2.3060145E-01 1.1547665E-01 4.1682442E-02 10 1.1020386E+02 3.0060223E-01 9.1951347E-02 3.1922394E-02 1.1226182E-02 11 5.0964757E+01 6.9827825E-02 -4.1224998E-01 -3.1037187E-01 -1.2449405E-01 12 2.4805498E+01 -1.1624710E-03 -5.6858364E-01 -4.4182484E-01 -1.7014943E-01 13 1.1649667E+01 1.4168166E-03 -1.4965412E-01 3.0900926E-01 1.6915145E-01 14 5.5280209E+00 -8.0597353E-04 3.5100830E-04 7.1343124E-01 4.2927564E-01 15 2.5241256E+00 3.3114791E-04 -2.6340116E-03 2.1537415E-01 -3.5735653E-02 16 1.0287074E+00 -1.3631963E-04 8.7273104E-04 4.4045126E-03 -6.8198249E-01 17 4.0980111E-01 4.8618006E-05 -2.9582442E-04 1.0039022E-03 -4.1725699E-01 18 9.0990959E-02 -1.2929199E-05 7.9547384E-05 -2.4787425E-04 -2.5017096E-02 19 3.0582682E-02 5.0814644E-06 -3.1239067E-05 9.2082256E-05 4.6267194E-03 2p+ 3p+ 4p+ 5p+ 1 4.0818814E+06 1.7986214E-06 9.2430378E-07 4.4640942E-07 1.5553004E-07 2 6.0219881E+05 1.7345116E-05 8.8845503E-06 4.2836737E-06 1.5020205E-06 3 1.2441686E+05 1.3260244E-04 6.8444740E-05 3.3088374E-05 1.1534006E-05 4 3.1579943E+04 8.7524923E-04 4.5126324E-04 2.1792003E-04 7.6394109E-05 5 9.4564371E+03 4.8604285E-03 2.5306773E-03 1.2257763E-03 4.2765510E-04 6 3.2577399E+03 2.2142495E-02 1.1617419E-02 5.6331851E-03 1.9759387E-03 7 1.2563399E+03 8.0077246E-02 4.3294761E-02 2.1156264E-02 7.3931986E-03 8 5.2805546E+02 2.1749591E-01 1.2257739E-01 6.0454650E-02 2.1295506E-02 9 2.3611837E+02 3.8743835E-01 2.3450644E-01 1.1792883E-01 4.1341833E-02 10 1.1020386E+02 3.5424868E-01 1.6837215E-01 7.6725908E-02 2.7060405E-02 11 5.0964757E+01 1.0694437E-01 -3.1809741E-01 -2.4083041E-01 -9.3421580E-02 12 2.4805498E+01 -9.3304995E-04 -6.1932008E-01 -4.9686817E-01 -1.8786443E-01 13 1.1649667E+01 2.7045907E-03 -2.1160244E-01 1.6191538E-01 9.1735852E-02 14 5.5280209E+00 -1.5669394E-03 -2.4336804E-03 7.3728259E-01 4.1786347E-01 15 2.5241256E+00 6.8963436E-04 -3.8973831E-03 2.9653422E-01 8.2625467E-02 16 1.0287074E+00 -2.8658340E-04 1.3603951E-03 1.1598321E-02 -6.0635192E-01 17 4.0980111E-01 1.0244020E-04 -4.7129215E-04 1.1068263E-03 -5.2915678E-01 18 9.0990959E-02 -2.7403372E-05 1.2758687E-04 -2.9413635E-04 -5.2407374E-02 19 3.0582682E-02 1.0768465E-05 -5.0190710E-05 1.1042271E-04 1.1076654E-02 3d- 4d- 5d- 1 3.3900482E+03 1.6301656E-03 8.0337216E-04 1.6473271E-04 2 9.2822504E+02 1.1762511E-02 5.8361107E-03 1.1957641E-03 3 3.4102047E+02 5.7042046E-02 2.8667193E-02 5.8962678E-03 4 1.4384093E+02 1.8509196E-01 9.4903039E-02 1.9533261E-02 5 6.5516490E+01 3.7344239E-01 1.9010652E-01 3.9223250E-02 6 3.1092296E+01 4.0548806E-01 1.6101786E-01 3.1121565E-02 7 1.4845188E+01 1.6872288E-01 -2.0386704E-01 -5.3416117E-02 8 6.9314405E+00 1.5980023E-02 -5.4066218E-01 -1.3276943E-01 9 3.0800094E+00 1.2817541E-03 -3.7012331E-01 -5.4888211E-02 10 1.1649710E+00 -1.1683381E-04 -5.6523781E-02 2.5685967E-01 11 3.9237627E-01 8.3210715E-05 2.1633398E-03 5.2157348E-01 12 1.1463976E-01 -2.3945822E-05 -8.9104111E-04 4.7079350E-01 3d+ 4d+ 5d+ 1 3.3900482E+03 8.9503267E-04 4.3990927E-04 8.8003095E-05 2 9.2822504E+02 9.1721792E-03 4.5383263E-03 9.0755995E-04 3 3.4102047E+02 5.0496358E-02 2.5288157E-02 5.0717617E-03 4 1.4384093E+02 1.7421278E-01 8.9122632E-02 1.7907165E-02 5 6.5516490E+01 3.6577799E-01 1.8647756E-01 3.7524756E-02 6 3.1092296E+01 4.1408477E-01 1.7100617E-01 3.2735587E-02 7 1.4845188E+01 1.8113145E-01 -1.8055371E-01 -4.6773750E-02 8 6.9314405E+00 1.8422127E-02 -5.3470945E-01 -1.2752860E-01 9 3.0800094E+00 1.3808329E-03 -3.9041130E-01 -6.4272810E-02 10 1.1649710E+00 -1.0402494E-04 -6.4813107E-02 2.3418446E-01 11 3.9237627E-01 8.5821466E-05 2.5223884E-03 5.1401347E-01 12 1.1463976E-01 -2.4575166E-05 -1.0714364E-03 4.9809845E-01 4f- 1 2.3315907E+02 4.7687629E-03 2 7.9064953E+01 3.4538338E-02 3 3.2348736E+01 1.2670934E-01 4 1.4367656E+01 2.7854292E-01 5 6.4498202E+00 3.7614640E-01 6 2.8021056E+00 3.4096768E-01 7 1.1260243E+00 1.9766093E-01 8 3.8547549E-01 5.0033902E-02 4f+ 1 2.3315907E+02 4.3036465E-03 2 7.9064953E+01 3.2805264E-02 3 3.2348736E+01 1.2293388E-01 4 1.4367656E+01 2.7296296E-01 5 6.4498202E+00 3.7386268E-01 6 2.8021056E+00 3.4446883E-01 7 1.1260243E+00 2.0521734E-01 8 3.8547549E-01 5.5731192E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.8655750E+07 2.6062192E-04 9.7873847E-05 4.6229905E-05 2.2580209E-05 8.9013505E-06 2.4387266E-06 2 1.0162738E+07 9.4390320E-04 3.5400361E-04 1.6749015E-04 8.1729289E-05 3.2214092E-05 8.8261536E-06 3 2.6555530E+06 2.2270749E-03 8.3736201E-04 3.9550235E-04 1.9320784E-04 7.6166542E-05 2.0867461E-05 4 7.7479033E+05 4.8164980E-03 1.8093819E-03 8.5666744E-04 4.1796602E-04 1.6474160E-04 4.5137131E-05 5 2.4763412E+05 9.6475603E-03 3.6434383E-03 1.7213145E-03 8.4122087E-04 3.3165021E-04 9.0862186E-05 6 8.5154884E+04 1.8297325E-02 6.9291438E-03 3.2870109E-03 1.6038054E-03 6.3216324E-04 1.7320880E-04 7 3.1200957E+04 3.2570740E-02 1.2541071E-02 5.9402915E-03 2.9063552E-03 1.1460853E-03 3.1399525E-04 8 1.2078618E+04 5.3599364E-02 2.1141501E-02 1.0109789E-02 4.9388410E-03 1.9473326E-03 5.3359619E-04 9 4.9069917E+03 7.7492304E-02 3.2729997E-02 1.5732512E-02 7.7325559E-03 3.0522096E-03 8.3629050E-04 10 2.0797575E+03 8.8971506E-02 4.2374838E-02 2.1026234E-02 1.0343290E-02 4.0850794E-03 1.1197155E-03 11 9.1548773E+02 6.4633579E-02 3.8777894E-02 1.9787092E-02 9.9203643E-03 3.9324154E-03 1.0778305E-03 12 4.1721154E+02 1.9793619E-02 3.5850284E-03 1.3661313E-03 4.8231362E-04 1.7508530E-04 4.8047485E-05 13 1.8530823E+02 1.0542251E-03 -4.1874067E-02 -3.5049144E-02 -1.9376731E-02 -7.8590192E-03 -2.1625690E-03 14 8.6777652E+01 7.2954061E-06 -3.2944894E-02 -3.5617582E-02 -2.2156283E-02 -9.2422517E-03 -2.5497954E-03 15 3.5694466E+01 -1.1397261E-05 -3.9165380E-03 1.6674945E-02 1.6451718E-02 7.5967342E-03 2.1229744E-03 16 1.8543018E+01 5.0882110E-06 4.5203763E-04 2.2645300E-02 2.7345775E-02 1.3371011E-02 3.7763312E-03 17 7.4692683E+00 -1.7488227E-06 -9.8711768E-05 2.0697245E-03 -1.0274226E-02 -7.3698222E-03 -2.1820076E-03 18 3.6765607E+00 6.9495094E-07 3.2019126E-05 -1.7726653E-04 -1.0595186E-02 -9.7090099E-03 -3.0448621E-03 19 1.0677454E+00 -1.4558961E-07 -5.3912244E-06 2.5908077E-05 -3.9786198E-04 4.5759785E-03 1.8413957E-03 20 4.8782008E-01 5.3154476E-08 1.6897620E-06 -8.2730569E-06 6.2663237E-05 2.8609718E-03 1.8690975E-03 21 9.1800954E-02 -8.2006917E-09 -1.5840474E-07 8.3829393E-07 -5.5388157E-06 5.8380833E-05 -1.1912854E-03 22 3.5802468E-02 3.0241898E-09 3.3499244E-08 -2.1633520E-07 1.5063926E-06 -6.6092127E-06 -6.8009267E-04 2p- 3p- 4p- 5p- 1 4.0818814E+06 8.1238163E-05 4.0654289E-05 1.9612594E-05 7.0674013E-06 2 6.0219881E+05 2.8489922E-04 1.4261479E-04 6.8815772E-05 2.4841995E-05 3 1.2441686E+05 8.3918401E-04 4.2230374E-04 2.0397340E-04 7.3463309E-05 4 3.1579943E+04 2.3349971E-03 1.1770848E-03 5.6891682E-04 2.0557719E-04 5 9.4564371E+03 6.0580397E-03 3.0859419E-03 1.4945786E-03 5.3831398E-04 6 3.2577399E+03 1.4210729E-02 7.3105097E-03 3.5500530E-03 1.2847351E-03 7 1.2563399E+03 2.8619846E-02 1.5206937E-02 7.4367135E-03 2.6819265E-03 8 5.2805546E+02 4.5276478E-02 2.5085306E-02 1.2400257E-02 4.5108008E-03 9 2.3611837E+02 4.7722691E-02 2.8054909E-02 1.4065239E-02 5.0774662E-03 10 1.1020386E+02 2.4913516E-02 7.7125985E-03 2.6993496E-03 9.5227589E-04 11 5.0964757E+01 3.5447931E-03 -2.4003147E-02 -1.8015629E-02 -7.2229936E-03 12 2.4805498E+01 -3.4692239E-04 -2.3140201E-02 -1.7968102E-02 -6.9203961E-03 13 1.1649667E+01 -1.5292197E-04 -4.1809802E-03 8.5701522E-03 4.6931692E-03 14 5.5280209E+00 -1.1195576E-04 4.0370939E-06 1.3672700E-02 8.2286203E-03 15 2.5241256E+00 -6.5092101E-05 -3.6045145E-05 2.7818847E-03 -4.6502845E-04 16 1.0287074E+00 -3.3140462E-05 6.3362199E-06 3.1314090E-05 -5.6441747E-03 17 4.0980111E-01 -2.3409456E-05 -2.1831485E-06 1.5040657E-06 -2.1799817E-03 18 9.0990959E-02 -9.7414966E-06 -7.1221300E-08 -2.1582069E-06 -6.1819622E-05 19 3.0582682E-02 -3.2888694E-06 -1.3346589E-07 -3.9045210E-07 6.5134840E-06 2p+ 3p+ 4p+ 5p+ 1 4.0818814E+06 4.0083693E-06 2.0683387E-06 1.0009132E-06 3.4631582E-07 2 6.0219881E+05 3.2080500E-05 1.6322913E-05 7.8530625E-06 2.7643429E-06 3 1.2441686E+05 1.8506754E-04 9.5164138E-05 4.5979902E-05 1.5991426E-05 4 3.1579943E+04 8.4818577E-04 4.3382432E-04 2.0908327E-04 7.3342413E-05 5 9.4564371E+03 3.1107584E-03 1.6069949E-03 7.7704416E-04 2.7087410E-04 6 3.2577399E+03 9.2477039E-03 4.8103844E-03 2.3278764E-03 8.1641632E-04 7 1.2563399E+03 2.2010640E-02 1.1805905E-02 5.7589338E-03 2.0115485E-03 8 5.2805546E+02 3.9972402E-02 2.2367339E-02 1.1014197E-02 3.8788559E-03 9 2.3611837E+02 4.8383071E-02 2.9116684E-02 1.4626025E-02 5.1261664E-03 10 1.1020386E+02 3.0469232E-02 1.4466978E-02 6.6038358E-03 2.3297441E-03 11 5.0964757E+01 6.2739728E-03 -1.8446612E-02 -1.3947503E-02 -5.4094235E-03 12 2.4805498E+01 -3.7387272E-05 -2.5182647E-02 -2.0182119E-02 -7.6300193E-03 13 1.1649667E+01 7.5431091E-05 -5.9025551E-03 4.4966840E-03 2.5477107E-03 14 5.5280209E+00 -3.0009590E-05 -4.6769711E-05 1.4144356E-02 8.0143780E-03 15 2.5241256E+00 8.8752101E-06 -5.0568413E-05 3.8448396E-03 1.0715243E-03 16 1.0287074E+00 -2.3328311E-06 1.1260627E-05 9.6043295E-05 -5.0173983E-03 17 4.0980111E-01 5.1836363E-07 -2.4593449E-06 5.7686267E-06 -2.7637871E-03 18 9.0990959E-02 -6.2618431E-08 3.1279398E-07 -7.2061244E-07 -1.2897750E-04 19 3.0582682E-02 1.3346647E-08 -7.1023597E-08 1.5620597E-07 1.5803200E-05 3d- 4d- 5d- 1 3.3900482E+03 5.8156986E-04 2.8680431E-04 5.8840166E-05 2 9.2822504E+02 2.9828689E-03 1.4802827E-03 3.0326646E-04 3 3.4102047E+02 9.5936792E-03 4.8217572E-03 9.9179334E-04 4 1.4384093E+02 2.0934996E-02 1.0736866E-02 2.2099427E-03 5 6.5516490E+01 2.8885469E-02 1.4714493E-02 3.0362501E-03 6 3.1092296E+01 2.1721437E-02 8.6417966E-03 1.6710775E-03 7 1.4845188E+01 6.2338012E-03 -7.5661276E-03 -1.9820887E-03 8 6.9314405E+00 3.8792241E-04 -1.3731575E-02 -3.3720389E-03 9 3.0800094E+00 1.3522424E-05 -6.2676154E-03 -9.2993863E-04 10 1.1649710E+00 -3.9917337E-06 -5.8757777E-04 2.6758982E-03 11 3.9237627E-01 -2.9535477E-07 1.3461664E-05 3.1537720E-03 12 1.1463976E-01 -2.8922415E-07 -2.7990827E-06 1.5387584E-03 3d+ 4d+ 5d+ 1 3.3900482E+03 4.4080660E-04 2.1626313E-04 4.3255116E-05 2 9.2822504E+02 2.5546098E-03 1.2619007E-03 2.5228512E-04 3 3.4102047E+02 8.7911748E-03 4.3959556E-03 8.8146685E-04 4 1.4384093E+02 1.9980898E-02 1.0208869E-02 2.0508793E-03 5 6.5516490E+01 2.8494897E-02 1.4513347E-02 2.9201561E-03 6 3.1092296E+01 2.2287168E-02 9.2031615E-03 1.7619927E-03 7 1.4845188E+01 6.7456002E-03 -6.7031480E-03 -1.7364804E-03 8 6.9314405E+00 4.6845090E-04 -1.3587581E-02 -3.2402102E-03 9 3.0800094E+00 2.3573435E-05 -6.6149887E-03 -1.0890178E-03 10 1.1649710E+00 -1.1428838E-06 -6.7546809E-04 2.4398665E-03 11 3.9237627E-01 5.3866751E-07 1.5268117E-05 3.1081790E-03 12 1.1463976E-01 -8.5728342E-08 -3.5058651E-06 1.6280467E-03 4f- 1 2.3315907E+02 7.5473032E-04 2 7.9064953E+01 3.3074969E-03 3 3.2348736E+01 7.8381180E-03 4 1.4367656E+01 1.1527395E-02 5 6.4498202E+00 1.0444635E-02 6 2.8021056E+00 6.2442739E-03 7 1.1260243E+00 2.2950756E-03 8 3.8547549E-01 3.3989359E-04 4f+ 1 2.3315907E+02 7.0389521E-04 2 7.9064953E+01 3.1692967E-03 3 3.2348736E+01 7.6316643E-03 4 1.4367656E+01 1.1315049E-02 5 6.4498202E+00 1.0389787E-02 6 2.8021056E+00 6.3113207E-03 7 1.1260243E+00 2.3836323E-03 8 3.8547549E-01 3.7876319E-04 ** Ta ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9215649E+07 1.8695209E-04 7.0679173E-05 3.3486894E-05 1.6403968E-05 6.5702486E-06 1.8490686E-06 2 1.0371476E+07 5.3368378E-04 2.0255431E-04 9.6072617E-05 4.7058798E-05 1.8848413E-05 5.3044888E-06 3 2.7290247E+06 1.3330880E-03 5.0935799E-04 2.4168065E-04 1.1844934E-04 4.7447238E-05 1.3353334E-05 4 8.0011793E+05 3.1498315E-03 1.2136600E-03 5.7719036E-04 2.8284111E-04 1.1329830E-04 3.1885781E-05 5 2.5660733E+05 7.3786526E-03 2.8818278E-03 1.3714594E-03 6.7285051E-04 2.6958136E-04 7.5872456E-05 6 8.8437510E+04 1.7287250E-02 6.8462463E-03 3.2720690E-03 1.6045615E-03 6.4286437E-04 1.8092600E-04 7 3.2447457E+04 4.0229351E-02 1.6316814E-02 7.8050448E-03 3.8362250E-03 1.5375887E-03 4.3277511E-04 8 1.2569665E+04 9.0494114E-02 3.7818755E-02 1.8256508E-02 8.9666226E-03 3.5939067E-03 1.0115017E-03 9 5.1075234E+03 1.8497170E-01 8.2804347E-02 4.0209761E-02 1.9857838E-02 7.9673090E-03 2.2428736E-03 10 2.1645198E+03 3.0666177E-01 1.5427062E-01 7.7197573E-02 3.8168069E-02 1.5323018E-02 4.3134802E-03 11 9.5258899E+02 3.2591322E-01 2.0434518E-01 1.0491582E-01 5.2799153E-02 2.1269958E-02 5.9916273E-03 12 4.3415841E+02 1.4735108E-01 2.4681120E-02 7.7313345E-03 2.1868977E-03 7.3903455E-04 2.0052004E-04 13 1.9259677E+02 1.2186267E-02 -4.8583309E-01 -4.1089747E-01 -2.2855420E-01 -9.4273295E-02 -2.6636076E-02 14 9.0177892E+01 1.8830624E-05 -5.5708952E-01 -6.0646511E-01 -3.7856903E-01 -1.6055536E-01 -4.5559555E-02 15 3.7179051E+01 -2.2413741E-04 -1.0454224E-01 4.3672701E-01 4.3423251E-01 2.0421025E-01 5.8812612E-02 16 1.9332682E+01 1.3345358E-04 1.6819478E-02 8.3420184E-01 1.0120321E+00 5.0391091E-01 1.4619285E-01 17 7.8227253E+00 -7.2580061E-05 -5.9479132E-03 1.2275633E-01 -5.8169633E-01 -4.2654377E-01 -1.2972009E-01 18 3.8688637E+00 4.1295520E-05 2.8115529E-03 -1.5124450E-02 -8.8579247E-01 -8.3014545E-01 -2.7017520E-01 19 1.1436875E+00 -1.4710551E-05 -9.2935267E-04 4.2001924E-03 -6.3583552E-02 7.0774297E-01 3.0340125E-01 20 5.2809080E-01 7.1374384E-06 4.5122982E-04 -2.0129896E-03 1.4701304E-02 6.5258006E-01 4.2592433E-01 21 1.0307763E-01 -1.8331714E-06 -1.1421450E-04 4.8344732E-04 -2.9319831E-03 3.1835420E-02 -6.1404797E-01 22 3.9442134E-02 7.8406412E-07 4.8877605E-05 -2.0423320E-04 1.2366990E-03 -5.1915952E-03 -5.8295862E-01 2p- 3p- 4p- 5p- 1 4.4541135E+06 2.5514064E-04 1.2774604E-04 6.1850380E-05 2.2783024E-05 2 6.6020069E+05 7.7809801E-04 3.8971346E-04 1.8869861E-04 6.9518583E-05 3 1.3648393E+05 2.1104345E-03 1.0586104E-03 5.1276836E-04 1.8885950E-04 4 3.4565087E+04 5.5042712E-03 2.7686387E-03 1.3418427E-03 4.9467203E-04 5 1.0301892E+04 1.4775183E-02 7.4981513E-03 3.6419138E-03 1.3410542E-03 6 3.5287532E+03 4.1325938E-02 2.1239840E-02 1.0344637E-02 3.8217979E-03 7 1.3536099E+03 1.1169867E-01 5.9234653E-02 2.9069722E-02 1.0713044E-02 8 5.6645771E+02 2.5262049E-01 1.3963196E-01 6.9188941E-02 2.5703212E-02 9 2.5240401E+02 3.9206488E-01 2.2925251E-01 1.1534712E-01 4.2548344E-02 10 1.1749142E+02 3.0936421E-01 1.0471132E-01 3.9346342E-02 1.4290453E-02 11 5.4384280E+01 7.5948437E-02 -3.9260316E-01 -2.9614409E-01 -1.2154335E-01 12 2.6482032E+01 -9.2969824E-04 -5.7736720E-01 -4.5593968E-01 -1.8029587E-01 13 1.2545067E+01 1.5370936E-03 -1.6294975E-01 2.7303693E-01 1.5495124E-01 14 5.9552140E+00 -8.6836639E-04 -1.2205949E-03 7.2324390E-01 4.4693279E-01 15 2.7410715E+00 3.5900506E-04 -2.4943624E-03 2.3430047E-01 -1.5547903E-02 16 1.1158944E+00 -1.4629619E-04 8.1051266E-04 5.9551418E-03 -6.9336831E-01 17 4.4623388E-01 5.2441470E-05 -2.7119035E-04 8.4489594E-04 -4.1771414E-01 18 9.9590756E-02 -1.3701431E-05 7.2770835E-05 -2.0768150E-04 -2.4804290E-02 19 3.2748130E-02 5.2832960E-06 -2.7978603E-05 7.5372770E-05 4.4550017E-03 2p+ 3p+ 4p+ 5p+ 1 4.4541135E+06 1.7221837E-06 8.8754349E-07 4.3070054E-07 1.5358748E-07 2 6.6020069E+05 1.6365456E-05 8.4113714E-06 4.0708650E-06 1.4608293E-06 3 1.3648393E+05 1.2373313E-04 6.4048765E-05 3.1109213E-05 1.1099507E-05 4 3.4565087E+04 8.1210525E-04 4.2012472E-04 2.0366843E-04 7.3070914E-05 5 1.0301892E+04 4.5184115E-03 2.3591243E-03 1.1479670E-03 4.0994144E-04 6 3.5287532E+03 2.0733709E-02 1.0908964E-02 5.3097701E-03 1.9060893E-03 7 1.3536099E+03 7.5824903E-02 4.1051564E-02 2.0147512E-02 7.2064691E-03 8 5.6645771E+02 2.0932042E-01 1.1806721E-01 5.8419684E-02 2.1058020E-02 9 2.5240401E+02 3.8233260E-01 2.3134301E-01 1.1685575E-01 4.1940891E-02 10 1.1749142E+02 3.6326113E-01 1.8063650E-01 8.3980347E-02 3.0345103E-02 11 5.4384280E+01 1.1626513E-01 -2.9279201E-01 -2.2334415E-01 -8.8869038E-02 12 2.6482032E+01 -2.1379126E-04 -6.2383296E-01 -5.0521920E-01 -1.9617561E-01 13 1.2545067E+01 2.8900713E-03 -2.2981773E-01 1.1958683E-01 7.4393691E-02 14 5.9552140E+00 -1.6720417E-03 -5.4999018E-03 7.3823331E-01 4.2904147E-01 15 2.7410715E+00 7.3970192E-04 -3.6453963E-03 3.2170905E-01 1.0941455E-01 16 1.1158944E+00 -3.0471515E-04 1.2520837E-03 1.4791893E-02 -6.1400967E-01 17 4.4623388E-01 1.0934357E-04 -4.3021011E-04 8.0657441E-04 -5.3310128E-01 18 9.9590756E-02 -2.8776988E-05 1.1626790E-04 -2.1512143E-04 -5.1768463E-02 19 3.2748130E-02 1.1092668E-05 -4.4795315E-05 7.9205544E-05 1.0598682E-02 3d- 4d- 5d- 1 3.4972698E+03 1.6643542E-03 8.2645006E-04 1.8761726E-04 2 9.5570091E+02 1.1946850E-02 5.9708473E-03 1.3483797E-03 3 3.5066715E+02 5.7795535E-02 2.9274247E-02 6.6697596E-03 4 1.4779151E+02 1.8718987E-01 9.6691087E-02 2.1925491E-02 5 6.7273674E+01 3.7611319E-01 1.9289446E-01 4.4187708E-02 6 3.1916972E+01 4.0423269E-01 1.5914973E-01 3.3186086E-02 7 1.5216288E+01 1.6496526E-01 -2.1445538E-01 -6.0920761E-02 8 7.1014289E+00 1.4915326E-02 -5.4538444E-01 -1.5187096E-01 9 3.1587591E+00 1.2873001E-03 -3.6030195E-01 -4.6418689E-02 10 1.1734593E+00 -1.5635141E-04 -5.0324100E-02 3.0203375E-01 11 4.1469920E-01 9.3481063E-05 2.8424658E-03 5.2832259E-01 12 1.2725984E-01 -2.9055769E-05 -1.0563103E-03 4.0699305E-01 3d+ 4d+ 5d+ 1 3.4972698E+03 9.0190063E-04 4.4680124E-04 9.9004458E-05 2 9.5570091E+02 9.2563207E-03 4.6142045E-03 1.0155148E-03 3 3.5066715E+02 5.1001807E-02 2.5747040E-02 5.7152036E-03 4 1.4779151E+02 1.7592909E-01 9.0691677E-02 2.0056577E-02 5 6.7273674E+01 3.6833973E-01 1.8926451E-01 4.2236172E-02 6 3.1916972E+01 4.1333298E-01 1.6990573E-01 3.5204846E-02 7 1.5216288E+01 1.7763055E-01 -1.9030784E-01 -5.3333514E-02 8 7.1014289E+00 1.7307984E-02 -5.4018737E-01 -1.4583824E-01 9 3.1587591E+00 1.3917712E-03 -3.8149769E-01 -5.8501897E-02 10 1.1734593E+00 -1.4801333E-04 -5.8152678E-02 2.7660302E-01 11 4.1469920E-01 9.6709398E-05 3.3854010E-03 5.2327318E-01 12 1.2725984E-01 -3.0123239E-05 -1.2831230E-03 4.3788253E-01 4f- 1 2.5803434E+02 4.2486497E-03 2 8.7561917E+01 3.1456564E-02 3 3.6008299E+01 1.1809811E-01 4 1.6094987E+01 2.6856919E-01 5 7.3092619E+00 3.7430150E-01 6 3.2308467E+00 3.4679960E-01 7 1.3330360E+00 2.0073695E-01 8 4.7476634E-01 4.9846053E-02 4f+ 1 2.5803434E+02 3.8099564E-03 2 8.7561917E+01 2.9797996E-02 3 3.6008299E+01 1.1449834E-01 4 1.6094987E+01 2.6314206E-01 5 7.3092619E+00 3.7187828E-01 6 3.2308467E+00 3.5027209E-01 7 1.3330360E+00 2.0779369E-01 8 4.7476634E-01 5.4879808E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9215649E+07 2.6969136E-04 1.0172912E-04 4.8146299E-05 2.3590956E-05 9.4490945E-06 2.6592982E-06 2 1.0371476E+07 9.7494170E-04 3.6726634E-04 1.7410168E-04 8.5229332E-05 3.4133182E-05 9.6058414E-06 3 2.7290247E+06 2.2887014E-03 8.6436303E-04 4.0907013E-04 2.0046968E-04 8.0297982E-05 2.2598747E-05 4 8.0011793E+05 4.9294604E-03 1.8600690E-03 8.8236562E-04 4.3189687E-04 1.7296678E-04 4.8676391E-05 5 2.5660733E+05 9.8366539E-03 3.7314054E-03 1.7664219E-03 8.6599435E-04 3.4689761E-04 9.7631023E-05 6 8.8437510E+04 1.8599541E-02 7.0746523E-03 3.3624616E-03 1.6459530E-03 6.5919921E-04 1.8551182E-04 7 3.2447457E+04 3.3026846E-02 1.2770849E-02 6.0613291E-03 2.9748949E-03 1.1919432E-03 3.3547456E-04 8 1.2569665E+04 5.4259253E-02 2.1483531E-02 1.0292156E-02 5.0443627E-03 2.0209035E-03 5.6874150E-04 9 5.1075234E+03 7.8407308E-02 3.3208067E-02 1.5992574E-02 7.8846287E-03 3.1621875E-03 8.9014063E-04 10 2.1645198E+03 9.0187136E-02 4.2968417E-02 2.1349432E-02 1.0536613E-02 4.2283694E-03 1.1902292E-03 11 9.5258899E+02 6.5922320E-02 3.9386265E-02 2.0120305E-02 1.0114931E-02 4.0737766E-03 1.1475244E-03 12 4.3415841E+02 2.0495783E-02 3.8556277E-03 1.4724882E-03 5.3560558E-04 1.9894372E-04 5.5100834E-05 13 1.9259677E+02 1.1355161E-03 -4.2415681E-02 -3.5539627E-02 -1.9726899E-02 -8.1332231E-03 -2.2978138E-03 14 9.0177892E+01 1.8143128E-06 -3.3681391E-02 -3.6437837E-02 -2.2727425E-02 -9.6371774E-03 -2.7346089E-03 15 3.7179051E+01 -9.7897907E-06 -4.0601326E-03 1.6747508E-02 1.6617536E-02 7.8112168E-03 2.2495195E-03 16 1.9332682E+01 4.4306005E-06 4.6663772E-04 2.3230997E-02 2.8139288E-02 1.4008932E-02 4.0641193E-03 17 7.8227253E+00 -1.5942683E-06 -1.0347846E-04 2.1713071E-03 -1.0276182E-02 -7.5307872E-03 -2.2900315E-03 18 3.8688637E+00 6.5660407E-07 3.3930042E-05 -1.8681486E-04 -1.1015182E-02 -1.0320048E-02 -3.3586637E-03 19 1.1436875E+00 -1.4419072E-07 -5.8622866E-06 2.7893606E-05 -4.3012561E-04 4.7829139E-03 2.0502334E-03 20 5.2809080E-01 5.3874871E-08 1.8528026E-06 -8.9893844E-06 6.7641713E-05 2.9972848E-03 1.9561373E-03 21 1.0307763E-01 -8.6338941E-09 -1.7404677E-07 9.1455045E-07 -5.9744469E-06 6.4572987E-05 -1.2458958E-03 22 3.9442134E-02 3.1564381E-09 3.4755856E-08 -2.2585270E-07 1.5630657E-06 -6.5057129E-06 -7.3166767E-04 2p- 3p- 4p- 5p- 1 4.4541135E+06 8.2574327E-05 4.1415995E-05 2.0061279E-05 7.3857029E-06 2 6.6020069E+05 2.8760025E-04 1.4431504E-04 6.9901171E-05 2.5779566E-05 3 1.3648393E+05 8.3954723E-04 4.2338181E-04 2.0534767E-04 7.5561251E-05 4 3.4565087E+04 2.3178580E-03 1.1712871E-03 5.6821077E-04 2.0976492E-04 5 1.0301892E+04 5.9904803E-03 3.0574962E-03 1.4870797E-03 5.4721881E-04 6 3.5287532E+03 1.4055039E-02 7.2447571E-03 3.5305213E-03 1.3053113E-03 7 1.3536099E+03 2.8443745E-02 1.5122279E-02 7.4256071E-03 2.7358810E-03 8 5.6645771E+02 4.5496352E-02 2.5212014E-02 1.2498779E-02 4.6446763E-03 9 2.5240401E+02 4.8956104E-02 2.8778398E-02 1.4496899E-02 5.3479859E-03 10 1.1749142E+02 2.6464096E-02 9.0720618E-03 3.4338541E-03 1.2504403E-03 11 5.4384280E+01 4.0122847E-03 -2.3611143E-02 -1.7750759E-02 -7.2816459E-03 12 2.6482032E+01 -3.5902570E-04 -2.4278028E-02 -1.9155084E-02 -7.5752039E-03 13 1.2545067E+01 -1.6157290E-04 -4.7238958E-03 7.8523872E-03 4.4586681E-03 14 5.9552140E+00 -1.2168475E-04 -2.7087833E-05 1.4385705E-02 8.8914512E-03 15 2.7410715E+00 -6.9880319E-05 -3.5634888E-05 3.1543347E-03 -2.1197991E-04 16 1.1158944E+00 -3.6300442E-05 6.0764664E-06 4.5676054E-05 -5.9766753E-03 17 4.4623388E-01 -2.5311580E-05 -2.1297436E-06 5.3555349E-07 -2.2773475E-03 18 9.9590756E-02 -1.0689370E-05 -8.8232726E-08 -2.2438669E-06 -6.4140141E-05 19 3.2748130E-02 -3.6046588E-06 -1.3328411E-07 -4.6417414E-07 6.4814454E-06 2p+ 3p+ 4p+ 5p+ 1 4.4541135E+06 3.8136558E-06 1.9725529E-06 9.6022838E-07 3.4003541E-07 2 6.6020069E+05 3.0371430E-05 1.5510998E-05 7.4854244E-06 2.6968421E-06 3 1.3648393E+05 1.7516971E-04 9.0321348E-05 4.3861375E-05 1.5612978E-05 4 3.4565087E+04 8.0609874E-04 4.1368654E-04 2.0010998E-04 7.1841085E-05 5 1.0301892E+04 2.9805309E-03 1.5436937E-03 7.4991413E-04 2.6756547E-04 6 3.5287532E+03 8.9495641E-03 4.6674239E-03 2.2670475E-03 8.1368440E-04 7 1.3536099E+03 2.1555452E-02 1.1574383E-02 5.6703183E-03 2.0271866E-03 8 5.6645771E+02 3.9776442E-02 2.2270187E-02 1.1001166E-02 3.9644468E-03 9 2.5240401E+02 4.9331125E-02 2.9670279E-02 1.4969494E-02 5.3713489E-03 10 1.1749142E+02 3.2257172E-02 1.6013818E-02 7.4547734E-03 2.6942525E-03 11 5.4384280E+01 7.0472333E-03 -1.7527288E-02 -1.3352194E-02 -5.3118917E-03 12 2.6482032E+01 -8.2204954E-06 -2.6207289E-02 -2.1200341E-02 -8.2310246E-03 13 1.2545067E+01 8.3730899E-05 -6.6528870E-03 3.4422175E-03 2.1421387E-03 14 5.9552140E+00 -3.3283628E-05 -1.0964079E-04 1.4699302E-02 8.5404707E-03 15 2.7410715E+00 9.9421333E-06 -4.9320231E-05 4.3468906E-03 1.4785480E-03 16 1.1158944E+00 -2.5918799E-06 1.0806195E-05 1.2756399E-04 -5.2916766E-03 17 4.4623388E-01 5.8036856E-07 -2.3466728E-06 4.3835382E-06 -2.9055363E-03 18 9.9590756E-02 -6.9510546E-08 2.9919792E-07 -5.5067446E-07 -1.3328967E-04 19 3.2748130E-02 1.4480389E-08 -6.5966285E-08 1.1566141E-07 1.5647248E-05 3d- 4d- 5d- 1 3.4972698E+03 5.9753303E-04 2.9695157E-04 6.7523070E-05 2 9.5570091E+02 3.0626803E-03 1.5309665E-03 3.4557970E-04 3 3.5066715E+02 9.8421559E-03 4.9856156E-03 1.1361238E-03 4 1.4779151E+02 2.1447960E-02 1.1081706E-02 2.5127785E-03 5 6.7273674E+01 2.9472221E-02 1.5125908E-02 3.4655119E-03 6 3.1916972E+01 2.1936378E-02 8.6539656E-03 1.8054707E-03 7 1.5216288E+01 6.1683662E-03 -8.0576814E-03 -2.2884705E-03 8 7.1014289E+00 3.6479963E-04 -1.4020173E-02 -3.9041733E-03 9 3.1587591E+00 1.3480464E-05 -6.1785983E-03 -7.9654833E-04 10 1.1734593E+00 -4.4906605E-06 -5.2482947E-04 3.1579405E-03 11 4.1469920E-01 -2.0613849E-07 1.8045386E-05 3.2841911E-03 12 1.2725984E-01 -3.4635730E-07 -3.5046099E-06 1.4015263E-03 3d+ 4d+ 5d+ 1 3.4972698E+03 4.4950279E-04 2.2227212E-04 4.9262664E-05 2 9.5570091E+02 2.6118140E-03 1.2997122E-03 2.8592883E-04 3 3.5066715E+02 8.9978098E-03 4.5352925E-03 1.0065532E-03 4 1.4779151E+02 2.0447717E-02 1.0527088E-02 2.3275878E-03 5 6.7273674E+01 2.9074752E-02 1.4925031E-02 3.3302644E-03 6 3.1916972E+01 2.2540415E-02 9.2649677E-03 1.9200650E-03 7 1.5216288E+01 6.6977630E-03 -7.1531309E-03 -2.0045424E-03 8 7.1014289E+00 4.4548340E-04 -1.3894132E-02 -3.7505563E-03 9 3.1587591E+00 2.4061154E-05 -6.5461588E-03 -1.0039073E-03 10 1.1734593E+00 -1.6084746E-06 -6.0827208E-04 2.8922921E-03 11 4.1469920E-01 6.2310084E-07 2.1063581E-05 3.2529411E-03 12 1.2725984E-01 -1.0990395E-07 -4.4232175E-06 1.5079517E-03 4f- 1 2.5803434E+02 7.0345285E-04 2 8.7561917E+01 3.1642367E-03 3 3.6008299E+01 7.7017659E-03 4 1.6094987E+01 1.1759954E-02 5 7.3092619E+00 1.1062606E-02 6 3.2308467E+00 6.8192054E-03 7 1.3330360E+00 2.5358760E-03 8 4.7476634E-01 3.7575653E-04 4f+ 1 2.5803434E+02 6.5418826E-04 2 8.7561917E+01 3.0270064E-03 3 3.6008299E+01 7.4964851E-03 4 1.6094987E+01 1.1543347E-02 5 7.3092619E+00 1.1001120E-02 6 3.2308467E+00 6.8910504E-03 7 1.3330360E+00 2.6260747E-03 8 4.7476634E-01 4.1392806E-04 ** W ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9493396E+07 1.9703216E-04 7.4824736E-05 3.5519041E-05 1.7456446E-05 7.0971158E-06 2.0319460E-06 2 1.0529808E+07 5.5831404E-04 2.1286330E-04 1.0115548E-04 4.9711519E-05 2.0210953E-05 5.7864147E-06 3 2.7917950E+06 1.3840053E-03 5.3122501E-04 2.5254594E-04 1.2418006E-04 5.0492081E-05 1.4456521E-05 4 8.2297574E+05 3.2437221E-03 1.2556469E-03 5.9831084E-04 2.9416020E-04 1.1960889E-04 3.4244305E-05 5 2.6497295E+05 7.5362687E-03 2.9574288E-03 1.4102603E-03 6.9415483E-04 2.8230642E-04 8.0831829E-05 6 9.1562745E+04 1.7512314E-02 6.9700827E-03 3.3378436E-03 1.6422877E-03 6.6790853E-04 1.9122466E-04 7 3.3651601E+04 4.0449395E-02 1.6490717E-02 7.9048789E-03 3.8980470E-03 1.5859010E-03 4.5412593E-04 8 1.3048969E+04 9.0438079E-02 3.7988866E-02 1.8375191E-02 9.0554752E-03 3.6843696E-03 1.0548660E-03 9 5.3047313E+03 1.8412305E-01 8.2783150E-02 4.0283197E-02 1.9958730E-02 8.1283449E-03 2.3280595E-03 10 2.2483241E+03 3.0497981E-01 1.5376609E-01 7.7066241E-02 3.8232302E-02 1.5581313E-02 4.4616507E-03 11 9.8939259E+02 3.2536905E-01 2.0350131E-01 1.0461317E-01 5.2800073E-02 2.1588784E-02 6.1885823E-03 12 4.5097341E+02 1.4889371E-01 2.5420030E-02 7.8476079E-03 2.2500634E-03 7.7743080E-04 2.1042735E-04 13 1.9993609E+02 1.2726279E-02 -4.8322812E-01 -4.0936216E-01 -2.2864960E-01 -9.5791483E-02 -2.7529615E-02 14 9.3620117E+01 -5.0865282E-05 -5.5802299E-01 -6.0799057E-01 -3.8065471E-01 -1.6393372E-01 -4.7365641E-02 15 3.8693780E+01 -1.8724399E-04 -1.0593306E-01 4.3061290E-01 4.3074232E-01 2.0595742E-01 6.0481048E-02 16 2.0138186E+01 1.1185126E-04 1.6957202E-02 8.3745884E-01 1.0193136E+00 5.1646582E-01 1.5253263E-01 17 8.1851995E+00 -6.3450448E-05 -6.0755193E-03 1.2557828E-01 -5.6921808E-01 -4.2659522E-01 -1.3217884E-01 18 4.0679902E+00 3.7238057E-05 2.8949836E-03 -1.5495211E-02 -8.9690843E-01 -8.5793585E-01 -2.8633995E-01 19 1.2228791E+00 -1.3459980E-05 -9.6747119E-04 4.3267948E-03 -6.5983552E-02 7.1651087E-01 3.2204908E-01 20 5.6835185E-01 6.5000355E-06 4.6859846E-04 -2.0689148E-03 1.5025923E-02 6.5580126E-01 4.2436248E-01 21 1.1352791E-01 -1.6499434E-06 -1.1693438E-04 4.8910729E-04 -2.9443957E-03 3.2542834E-02 -6.0797831E-01 22 4.2712144E-02 6.8922143E-07 4.8873918E-05 -2.0135832E-04 1.2143688E-03 -4.9018082E-03 -5.9258220E-01 2p- 3p- 4p- 5p- 1 4.8422569E+06 2.5734200E-04 1.2914166E-04 6.2779939E-05 2.3584796E-05 2 7.2169973E+05 7.8219387E-04 3.9265828E-04 1.9089273E-04 7.1723569E-05 3 1.4937420E+05 2.1095511E-03 1.0604804E-03 5.1576590E-04 1.9373861E-04 4 3.7764362E+04 5.4571199E-03 2.7508531E-03 1.3384879E-03 5.0322208E-04 5 1.1207806E+04 1.4488916E-02 7.3656446E-03 3.5922399E-03 1.3490739E-03 6 3.8181988E+03 4.0123461E-02 2.0656699E-02 1.0097664E-02 3.8044492E-03 7 1.4570277E+03 1.0814207E-01 5.7374585E-02 2.8271507E-02 1.0625927E-02 8 6.0710712E+02 2.4628167E-01 1.3614896E-01 6.7668693E-02 2.5635117E-02 9 2.6958495E+02 3.8940800E-01 2.2761072E-01 1.1505249E-01 4.3292890E-02 10 1.2516685E+02 3.1758215E-01 1.1665875E-01 4.6369387E-02 1.7295301E-02 11 5.8012110E+01 8.2279990E-02 -3.7258919E-01 -2.8175568E-01 -1.1812979E-01 12 2.8257508E+01 -5.6812783E-04 -5.8493166E-01 -4.6852067E-01 -1.8980334E-01 13 1.3494141E+01 1.6287369E-03 -1.7683139E-01 2.3786111E-01 1.4033802E-01 14 6.3989712E+00 -9.1443441E-04 -3.0921258E-03 7.3170596E-01 4.6349280E-01 15 2.9639320E+00 3.7964641E-04 -2.2971425E-03 2.5247014E-01 3.1577281E-03 16 1.2051418E+00 -1.5327237E-04 7.3252169E-04 7.4868360E-03 -7.0411142E-01 17 4.8298797E-01 5.5125156E-05 -2.4027178E-04 6.9179251E-04 -4.1777563E-01 18 1.0768928E-01 -1.4134838E-05 6.4536809E-05 -1.6807009E-04 -2.4356303E-02 19 3.4720311E-02 5.3712068E-06 -2.4399026E-05 5.9833768E-05 4.3154836E-03 2p+ 3p+ 4p+ 5p+ 1 4.8422569E+06 1.6557080E-06 8.5563422E-07 4.1724151E-07 1.5196051E-07 2 7.2169973E+05 1.5496481E-05 7.9917947E-06 3.8830557E-06 1.4230157E-06 3 1.4937420E+05 1.1583630E-04 6.0126602E-05 2.9344812E-05 1.0693501E-05 4 3.7764362E+04 7.5542386E-04 3.9211528E-04 1.9085639E-04 6.9928614E-05 5 1.1207806E+04 4.2076003E-03 2.2027939E-03 1.0769683E-03 3.9279837E-04 6 3.8181988E+03 1.9434197E-02 1.0254228E-02 5.0109161E-03 1.8369744E-03 7 1.4570277E+03 7.1830675E-02 3.8942385E-02 1.9197767E-02 7.0133167E-03 8 6.0710712E+02 2.0139992E-01 1.1370104E-01 5.6453847E-02 2.0779051E-02 9 2.6958495E+02 3.7682175E-01 2.2789775E-01 1.1562658E-01 4.2394453E-02 10 1.2516685E+02 3.7149534E-01 1.9187724E-01 9.0731237E-02 3.3510352E-02 11 5.8012110E+01 1.2587322E-01 -2.6728629E-01 -2.0583510E-01 -8.3869218E-02 12 2.8257508E+01 7.7959058E-04 -6.2646362E-01 -5.1157249E-01 -2.0348254E-01 13 1.3494141E+01 3.0183769E-03 -2.4871163E-01 7.8246022E-02 5.6611637E-02 14 6.3989712E+00 -1.7433282E-03 -9.1138150E-03 7.3744516E-01 4.3875308E-01 15 2.9639320E+00 7.7440322E-04 -3.3003730E-03 3.4606488E-01 1.3492582E-01 16 1.2051418E+00 -3.1652889E-04 1.1161402E-03 1.7962778E-02 -6.2098268E-01 17 4.8298797E-01 1.1381210E-04 -3.7812737E-04 5.2996654E-04 -5.3689327E-01 18 1.0768928E-01 -2.9435998E-05 1.0239760E-04 -1.4054705E-04 -5.1013997E-02 19 3.4720311E-02 1.1180216E-05 -3.8806719E-05 5.1119177E-05 1.0267717E-02 3d- 4d- 5d- 1 3.6582313E+03 1.6594893E-03 8.3014863E-04 2.0332385E-04 2 9.9704691E+02 1.1841710E-02 5.9628877E-03 1.4509248E-03 3 3.6529249E+02 5.7275484E-02 2.9226111E-02 7.1859532E-03 4 1.5383911E+02 1.8598461E-01 9.6795568E-02 2.3649098E-02 5 7.0017501E+01 3.7517340E-01 1.9392404E-01 4.7980022E-02 6 3.3232237E+01 4.0494082E-01 1.6106947E-01 3.5983545E-02 7 1.5859414E+01 1.6637753E-01 -2.1396534E-01 -6.5622327E-02 8 7.4155575E+00 1.5238897E-02 -5.4662646E-01 -1.6624841E-01 9 3.3165471E+00 1.2804031E-03 -3.5908133E-01 -4.5824504E-02 10 1.2392813E+00 -1.7190903E-04 -4.9126609E-02 3.2965431E-01 11 4.4991367E-01 9.6156626E-05 2.9475246E-03 5.3124153E-01 12 1.4194723E-01 -3.1527363E-05 -1.1136032E-03 3.6835706E-01 3d+ 4d+ 5d+ 1 3.6582313E+03 8.8284812E-04 4.4070247E-04 1.0534970E-04 2 9.9704691E+02 9.0929343E-03 4.5679793E-03 1.0823959E-03 3 3.6529249E+02 5.0317087E-02 2.5594922E-02 6.1279205E-03 4 1.5383911E+02 1.7440034E-01 9.0604069E-02 2.1576182E-02 5 7.0017501E+01 3.6709402E-01 1.9016774E-01 4.5806737E-02 6 3.3232237E+01 4.1420392E-01 1.7218867E-01 3.8252956E-02 7 1.5859414E+01 1.7946248E-01 -1.8903707E-01 -5.7202029E-02 8 7.4155575E+00 1.7752945E-02 -5.4138618E-01 -1.5951291E-01 9 3.3165471E+00 1.3880971E-03 -3.8090135E-01 -5.9676908E-02 10 1.2392813E+00 -1.6395455E-04 -5.6989157E-02 3.0210810E-01 11 4.4991367E-01 9.9165697E-05 3.5415764E-03 5.2784858E-01 12 1.4194723E-01 -3.2744459E-05 -1.3602368E-03 4.0185951E-01 4f- 1 2.8199130E+02 3.8776869E-03 2 9.5729811E+01 2.9199219E-02 3 3.9526315E+01 1.1171680E-01 4 1.7753859E+01 2.6088955E-01 5 8.1354884E+00 3.7291092E-01 6 3.6446495E+00 3.5131318E-01 7 1.5340321E+00 2.0250995E-01 8 5.6143065E-01 4.9146696E-02 4f+ 1 2.8199130E+02 3.4555656E-03 2 9.5729811E+01 2.7584901E-02 3 3.9526315E+01 1.0821405E-01 4 1.7753859E+01 2.5555151E-01 5 8.1354884E+00 3.7036360E-01 6 3.6446495E+00 3.5480394E-01 7 1.5340321E+00 2.0928078E-01 8 5.6143065E-01 5.3718658E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9493396E+07 2.7984749E-04 1.0603175E-04 5.0279467E-05 2.4716506E-05 1.0048969E-05 2.8771679E-06 2 1.0529808E+07 1.0096736E-03 3.8205253E-04 1.8145244E-04 8.9120819E-05 3.6229709E-05 1.0372181E-05 3 2.7917950E+06 2.3574312E-03 8.9431166E-04 4.2406452E-04 2.0849458E-04 8.4769484E-05 2.4271059E-05 4 8.2297574E+05 5.0551531E-03 1.9160850E-03 9.1064736E-04 4.4721493E-04 1.8180215E-04 5.2047138E-05 5 2.6497295E+05 1.0046345E-02 3.8280791E-03 1.8157327E-03 8.9306072E-04 3.6312352E-04 1.0397179E-04 6 9.1562745E+04 1.8932920E-02 7.2336780E-03 3.4444683E-03 1.6916980E-03 6.8774144E-04 1.9688673E-04 7 3.3651601E+04 3.3525377E-02 1.3019713E-02 6.1915859E-03 3.0486538E-03 1.2398722E-03 3.5502890E-04 8 1.3048969E+04 5.4967001E-02 2.1849862E-02 1.0486482E-02 5.1567608E-03 2.0971276E-03 6.0037331E-04 9 5.3047313E+03 7.9354604E-02 3.3708826E-02 1.6263961E-02 8.0439935E-03 3.2746048E-03 9.3784355E-04 10 2.2483241E+03 9.1380397E-02 4.3568626E-02 2.1677128E-02 1.0734024E-02 4.3727784E-03 1.2520414E-03 11 9.8939259E+02 6.7132038E-02 3.9953461E-02 2.0432490E-02 1.0301418E-02 4.2109573E-03 1.2070628E-03 12 4.5097341E+02 2.1141794E-02 4.0458929E-03 1.5302232E-03 5.6289040E-04 2.1305835E-04 5.9481968E-05 13 1.9993609E+02 1.2106559E-03 -4.2973624E-02 -3.6054711E-02 -2.0094787E-02 -8.4146446E-03 -2.4181043E-03 14 9.3620117E+01 -2.6584582E-06 -3.4383596E-02 -3.7220259E-02 -2.3284041E-02 -1.0025637E-02 -2.8966525E-03 15 3.8693780E+01 -8.4999875E-06 -4.1983149E-03 1.6841241E-02 1.6810436E-02 8.0338981E-03 2.3591078E-03 16 2.0138186E+01 3.9103508E-06 4.8009593E-04 2.3804239E-02 2.8926404E-02 1.4653977E-02 4.3277769E-03 17 8.1851995E+00 -1.4766662E-06 -1.0805185E-04 2.2722546E-03 -1.0285453E-02 -7.7034837E-03 -2.3866286E-03 18 4.0679902E+00 6.2967507E-07 3.5785035E-05 -1.9624342E-04 -1.1437030E-02 -1.0936595E-02 -3.6500774E-03 19 1.2228791E+00 -1.4389795E-07 -6.2977534E-06 2.9705286E-05 -4.6157863E-04 5.0069674E-03 2.2503039E-03 20 5.6835185E-01 5.4582662E-08 1.9898811E-06 -9.5814602E-06 7.1730153E-05 3.1248214E-03 2.0219070E-03 21 1.1352791E-01 -9.0119379E-09 -1.8575326E-07 9.7042144E-07 -6.2980494E-06 6.9271416E-05 -1.2946042E-03 22 4.2712144E-02 3.2836579E-09 3.5309664E-08 -2.3104560E-07 1.5979212E-06 -6.3906164E-06 -7.7396265E-04 2p- 3p- 4p- 5p- 1 4.8422569E+06 8.4076017E-05 4.2260999E-05 2.0555290E-05 7.7180030E-06 2 7.2169973E+05 2.9088586E-04 1.4630722E-04 7.1142901E-05 2.6758053E-05 3 1.4937420E+05 8.4158383E-04 4.2527353E-04 2.0713895E-04 7.7736364E-05 4 3.7764362E+04 2.3048843E-03 1.1674977E-03 5.6852935E-04 2.1404821E-04 5 1.1207806E+04 5.9314947E-03 3.0330745E-03 1.4815468E-03 5.5602395E-04 6 3.8181988E+03 1.3912501E-02 7.1854403E-03 3.5143671E-03 1.3251262E-03 7 1.4570277E+03 2.8276195E-02 1.5041806E-02 7.4168348E-03 2.7869269E-03 8 6.0710712E+02 4.5695413E-02 2.5328373E-02 1.2594528E-02 4.7728049E-03 9 2.6958495E+02 5.0144647E-02 2.9465961E-02 1.4912509E-02 5.6118879E-03 10 1.2516685E+02 2.8027685E-02 1.0432370E-02 4.1742714E-03 1.5605251E-03 11 5.8012110E+01 4.5191417E-03 -2.3140292E-02 -1.7435784E-02 -7.3062440E-03 12 2.8257508E+01 -3.6637627E-04 -2.5406323E-02 -2.0329067E-02 -8.2358503E-03 13 1.3494141E+01 -1.7164087E-04 -5.3164907E-03 7.0881751E-03 4.1850510E-03 14 6.3989712E+00 -1.3194052E-04 -6.6701133E-05 1.5085738E-02 9.5576962E-03 15 2.9639320E+00 -7.4927930E-05 -3.4235343E-05 3.5349677E-03 4.2247082E-05 16 1.2051418E+00 -3.9586178E-05 5.6360411E-06 6.0864830E-05 -6.3073578E-03 17 4.8298797E-01 -2.7323316E-05 -2.0243740E-06 -4.9838461E-07 -2.3696620E-03 18 1.0768928E-01 -1.1673444E-05 -1.0910132E-07 -2.3279355E-06 -6.5511729E-05 19 3.4720311E-02 -3.8934035E-06 -1.3050246E-07 -5.3448797E-07 6.4572538E-06 2p+ 3p+ 4p+ 5p+ 1 4.8422569E+06 3.6414887E-06 1.8875678E-06 9.2440484E-07 3.3430730E-07 2 7.2169973E+05 2.8829650E-05 1.4779471E-05 7.1554932E-06 2.6329074E-06 3 1.4937420E+05 1.6613709E-04 8.5887487E-05 4.1924371E-05 1.5241150E-05 4 3.7764362E+04 7.6704130E-04 3.9496978E-04 1.9178746E-04 7.0317350E-05 5 1.1207806E+04 2.8575831E-03 1.4837318E-03 7.2422444E-04 2.6390789E-04 6 3.8181988E+03 8.6627846E-03 4.5297244E-03 2.2086749E-03 8.0954538E-04 7 1.4570277E+03 2.1105696E-02 1.1345308E-02 5.5826585E-03 2.0383969E-03 8 6.0710712E+02 3.9549842E-02 2.2157184E-02 1.0982309E-02 4.0411420E-03 9 2.6958495E+02 5.0211297E-02 3.0177183E-02 1.5291868E-02 5.6052154E-03 10 1.2516685E+02 3.4044128E-02 1.7544882E-02 8.3043536E-03 3.0675981E-03 11 5.8012110E+01 7.8814203E-03 -1.6511939E-02 -1.2698886E-02 -5.1733781E-03 12 2.8257508E+01 3.4910521E-05 -2.7183214E-02 -2.2171308E-02 -8.8175417E-03 13 1.3494141E+01 9.0787474E-05 -7.4676665E-03 2.3301480E-03 1.6882251E-03 14 6.3989712E+00 -3.6022140E-05 -1.8831141E-04 1.5220455E-02 9.0529607E-03 15 2.9639320E+00 1.0846487E-05 -4.6469454E-05 4.8624420E-03 1.8958859E-03 16 1.2051418E+00 -2.8067979E-06 1.0025422E-05 1.6097764E-04 -5.5616519E-03 17 4.8298797E-01 6.3157388E-07 -2.1509201E-06 2.9926852E-06 -3.0443391E-03 18 1.0768928E-01 -7.4655729E-08 2.7522404E-07 -3.7324237E-07 -1.3658303E-04 19 3.4720311E-02 1.5281835E-08 -5.9299451E-08 7.6522640E-08 1.5608226E-05 3d- 4d- 5d- 1 3.6582313E+03 6.0093199E-04 3.0086283E-04 7.3838342E-05 2 9.9704691E+02 3.0830922E-03 1.5528190E-03 3.7762531E-04 3 3.6529249E+02 9.9317489E-03 5.0683559E-03 1.2464786E-03 4 1.5383911E+02 2.1720330E-02 1.1307471E-02 2.7624912E-03 5 7.0017501E+01 2.9979735E-02 1.5507605E-02 3.8374799E-03 6 3.3232237E+01 2.2418736E-02 8.9359132E-03 1.9974115E-03 7 1.5859414E+01 6.3500435E-03 -8.2064900E-03 -2.5162973E-03 8 7.4155575E+00 3.8056381E-04 -1.4359103E-02 -4.3671542E-03 9 3.3165471E+00 1.3353134E-05 -6.3094440E-03 -8.0582586E-04 10 1.2392813E+00 -4.9056626E-06 -5.2640794E-04 3.5420393E-03 11 4.4991367E-01 -2.1988157E-07 1.9489734E-05 3.4396761E-03 12 1.4194723E-01 -3.9860196E-07 -3.8961687E-06 1.3396675E-03 3d+ 4d+ 5d+ 1 3.6582313E+03 4.4781714E-04 2.2311367E-04 5.3353770E-05 2 9.9704691E+02 2.6149006E-03 1.3112785E-03 3.1056234E-04 3 3.6529249E+02 9.0512337E-03 4.5967020E-03 1.1003581E-03 4 1.5383911E+02 2.0671821E-02 1.0724827E-02 2.5533836E-03 5 7.0017501E+01 2.9557082E-02 1.5296165E-02 3.6840086E-03 6 3.3232237E+01 2.3048258E-02 9.5807069E-03 2.1288324E-03 7 1.5859414E+01 6.9086643E-03 -7.2532201E-03 -2.1946565E-03 8 7.4155575E+00 4.6695246E-04 -1.4229478E-02 -4.1918962E-03 9 3.3165471E+00 2.4599788E-05 -6.6972459E-03 -1.0493833E-03 10 1.2392813E+00 -1.8286135E-06 -6.1260475E-04 3.2463642E-03 11 4.4991367E-01 6.6697306E-07 2.2952669E-05 3.4178708E-03 12 1.4194723E-01 -1.2618047E-07 -4.9523616E-06 1.4615777E-03 4f- 1 2.8199130E+02 6.6763214E-04 2 9.5729811E+01 3.0656525E-03 3 3.9526315E+01 7.6276535E-03 4 1.7753859E+01 1.1994191E-02 5 8.1354884E+00 1.1626111E-02 6 3.6446495E+00 7.3365359E-03 7 1.5340321E+00 2.7442339E-03 8 5.6143065E-01 4.0283831E-04 4f+ 1 2.8199130E+02 6.1904635E-04 2 9.5729811E+01 2.9276509E-03 3 3.9526315E+01 7.4204262E-03 4 1.7753859E+01 1.1772238E-02 5 8.1354884E+00 1.1558423E-02 6 3.6446495E+00 7.4136486E-03 7 1.5340321E+00 2.8372861E-03 8 5.6143065E-01 4.4060246E-04 ** Re ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9752613E+07 2.0768172E-04 7.9226317E-05 3.7678689E-05 1.8579370E-05 7.6598515E-06 2.2180500E-06 2 1.0683831E+07 5.8419440E-04 2.2374903E-04 1.0652665E-04 5.2525693E-05 2.1655500E-05 6.2706040E-06 3 2.8539833E+06 1.4372408E-03 5.5419574E-04 2.6396463E-04 1.3022618E-04 5.3694848E-05 1.5548744E-05 4 8.4587464E+05 3.3415517E-03 1.2995786E-03 6.2040796E-04 3.0604622E-04 1.2619338E-04 3.6540869E-05 5 2.7341819E+05 7.7005035E-03 3.0363942E-03 1.4507416E-03 7.1645616E-04 2.9547196E-04 8.5566364E-05 6 9.4734216E+04 1.7748586E-02 7.0996980E-03 3.4064683E-03 1.6817255E-03 6.9358552E-04 2.0083621E-04 7 3.4877933E+04 4.0689170E-02 1.6674579E-02 8.0094495E-03 3.9627788E-03 1.6348937E-03 4.7350078E-04 8 1.3538220E+04 9.0416780E-02 3.8176151E-02 1.8501725E-02 9.1490657E-03 3.7750015E-03 1.0931049E-03 9 5.5062908E+03 1.8332639E-01 8.2788449E-02 4.0367534E-02 2.0066605E-02 8.2870083E-03 2.4006676E-03 10 2.3340177E+03 3.0333123E-01 1.5328995E-01 7.6945367E-02 3.8302915E-02 1.5831206E-02 4.5846405E-03 11 1.0270152E+03 3.2476160E-01 2.0262813E-01 1.0428618E-01 5.2791992E-02 2.1886085E-02 6.3462714E-03 12 4.6814112E+02 1.5033841E-01 2.5980075E-02 7.8563785E-03 2.2522642E-03 7.9251648E-04 2.1460675E-04 13 2.0745113E+02 1.3253376E-02 -4.8072664E-01 -4.0791963E-01 -2.2879625E-01 -9.7266210E-02 -2.8272952E-02 14 9.7146276E+01 -1.1657860E-04 -5.5879307E-01 -6.0927359E-01 -3.8263918E-01 -1.6715699E-01 -4.8876859E-02 15 4.0249039E+01 -1.5180312E-04 -1.0726859E-01 4.2472755E-01 4.2751060E-01 2.0759070E-01 6.1757758E-02 16 2.0964989E+01 9.0921543E-05 1.7078692E-02 8.4051168E-01 1.0264156E+00 5.2880719E-01 1.5812730E-01 17 8.5575880E+00 -5.4392340E-05 -6.1968630E-03 1.2833623E-01 -5.5732013E-01 -4.2689352E-01 -1.3412315E-01 18 4.2743559E+00 3.3106433E-05 2.9747641E-03 -1.5862693E-02 -9.0758787E-01 -8.8462853E-01 -3.0054111E-01 19 1.3054091E+00 -1.2095731E-05 -1.0003050E-03 4.4322561E-03 -6.8182376E-02 7.2586714E-01 3.3839801E-01 20 6.0905465E-01 5.7860212E-06 4.8136619E-04 -2.1063179E-03 1.5212083E-02 6.5856946E-01 4.2079355E-01 21 1.2346220E-01 -1.4524234E-06 -1.1842237E-04 4.9010656E-04 -2.9339254E-03 3.2861795E-02 -6.0331077E-01 22 4.5751293E-02 5.9549922E-07 4.8576215E-05 -1.9760503E-04 1.1891239E-03 -4.6634609E-03 -5.9923898E-01 2p- 3p- 4p- 5p- 1 5.2550019E+06 2.5972333E-04 1.3062454E-04 6.3761043E-05 2.4390023E-05 2 7.8796148E+05 7.8681920E-04 3.9585419E-04 1.9323177E-04 7.3925578E-05 3 1.6334535E+05 2.1099983E-03 1.0629547E-03 5.1909259E-04 1.9854433E-04 4 4.1240829E+04 5.4145497E-03 2.7351225E-03 1.3361545E-03 5.1148737E-04 5 1.2191800E+04 1.4221397E-02 7.2417328E-03 3.5463875E-03 1.3561685E-03 6 4.1315403E+03 3.8983617E-02 2.0102907E-02 9.8637287E-03 3.7838365E-03 7 1.5684536E+03 1.0471265E-01 5.5577116E-02 2.7497735E-02 1.0523615E-02 8 6.5069880E+02 2.3998217E-01 1.3268433E-01 6.6152819E-02 2.5514877E-02 9 2.8794482E+02 3.8633276E-01 2.2565688E-01 1.1458085E-01 4.3910750E-02 10 1.3335567E+02 3.2546689E-01 1.2812765E-01 5.3183789E-02 2.0298977E-02 11 6.1909723E+01 8.8999691E-02 -3.5175459E-01 -2.6681997E-01 -1.1411126E-01 12 3.0158261E+01 -4.7833153E-05 -5.9145687E-01 -4.7980118E-01 -1.9872674E-01 13 1.4509220E+01 1.6897720E-03 -1.9163856E-01 2.0264472E-01 1.2495798E-01 14 6.8635602E+00 -9.4373789E-04 -5.3021496E-03 7.3893976E-01 4.7894179E-01 15 3.1952322E+00 3.9292666E-04 -2.0422139E-03 2.7036523E-01 2.1253392E-02 16 1.2970608E+00 -1.5728693E-04 6.3855890E-04 9.0394443E-03 -7.1423191E-01 17 5.2039827E-01 5.6740050E-05 -2.0361863E-04 5.4042337E-04 -4.1778554E-01 18 1.1549167E-01 -1.4274104E-05 5.5114255E-05 -1.2896291E-04 -2.3782142E-02 19 3.6565102E-02 5.3609318E-06 -2.0542441E-05 4.5095892E-05 4.1898617E-03 2p+ 3p+ 4p+ 5p+ 1 5.2550019E+06 1.5945137E-06 8.2619957E-07 4.0487942E-07 1.5031673E-07 2 7.8796148E+05 1.4694739E-05 7.6039770E-06 3.7095485E-06 1.3856642E-06 3 1.6334535E+05 1.0857897E-04 5.6510009E-05 2.7714088E-05 1.0295297E-05 4 4.1240829E+04 7.0314268E-04 3.6619685E-04 1.7897646E-04 6.6841879E-05 5 1.2191800E+04 3.9180080E-03 2.0565888E-03 1.0103053E-03 3.7563807E-04 6 4.1315403E+03 1.8206476E-02 9.6337031E-03 4.7268722E-03 1.7662659E-03 7 1.5684536E+03 6.7991232E-02 3.6910280E-02 1.8278358E-02 6.8070136E-03 8 6.5069880E+02 1.9355541E-01 1.0937148E-01 5.4498523E-02 2.0444165E-02 9 2.8794482E+02 3.7080414E-01 2.2410391E-01 1.1420128E-01 4.2692097E-02 10 1.3335567E+02 3.7910817E-01 2.0234221E-01 9.7113222E-02 3.6587442E-02 11 6.1909723E+01 1.3598301E-01 -2.4109827E-01 -1.8791555E-01 -7.8302187E-02 12 3.0158261E+01 2.1141567E-03 -6.2722293E-01 -5.1596803E-01 -2.0976859E-01 13 1.4509220E+01 3.0829656E-03 -2.6866761E-01 3.7042745E-02 3.8111302E-02 14 6.8635602E+00 -1.7780520E-03 -1.3353761E-02 7.3481118E-01 4.4682970E-01 15 3.1952322E+00 7.9252252E-04 -2.8599127E-03 3.7017399E-01 1.5995684E-01 16 1.2970608E+00 -3.2170794E-04 9.5136634E-04 2.1195660E-02 -6.2713451E-01 17 5.2039827E-01 1.1586095E-04 -3.1558430E-04 2.6471827E-04 -5.4083922E-01 18 1.1549167E-01 -2.9439409E-05 8.6335788E-05 -6.8683260E-05 -5.0234354E-02 19 3.6565102E-02 1.1049966E-05 -3.2268249E-05 2.4962746E-05 1.0023239E-02 3d- 4d- 5d- 1 3.8353473E+03 1.6476778E-03 8.3032212E-04 2.1603355E-04 2 1.0424122E+03 1.1685588E-02 5.9287862E-03 1.5318013E-03 3 3.8131805E+02 5.6526019E-02 2.9054976E-02 7.5901992E-03 4 1.6046367E+02 1.8416386E-01 9.6573987E-02 2.5055178E-02 5 7.3027673E+01 3.7353131E-01 1.9460124E-01 5.1176465E-02 6 3.4678608E+01 4.0600570E-01 1.6373794E-01 3.8785060E-02 7 1.6573904E+01 1.6878060E-01 -2.1133401E-01 -6.9262011E-02 8 7.7678550E+00 1.5830306E-02 -5.4723628E-01 -1.7838598E-01 9 3.4963440E+00 1.2705676E-03 -3.5944854E-01 -4.7023823E-02 10 1.3216892E+00 -1.8216542E-04 -4.8939477E-02 3.5000848E-01 11 4.8898474E-01 9.6515931E-05 2.8745673E-03 5.3226602E-01 12 1.5722790E-01 -3.3211672E-05 -1.1336576E-03 3.4106946E-01 3d+ 4d+ 5d+ 1 3.8353473E+03 8.5952556E-04 4.3231131E-04 1.0975295E-04 2 1.0424122E+03 8.8870241E-03 4.4994537E-03 1.1313519E-03 3 3.8131805E+02 4.9419477E-02 2.5327677E-02 6.4396174E-03 4 1.6046367E+02 1.7226559E-01 9.0192878E-02 2.2795335E-02 5 7.3027673E+01 3.6509988E-01 1.9068856E-01 4.8796869E-02 6 3.4678608E+01 4.1535847E-01 1.7513912E-01 4.1255292E-02 7 1.6573904E+01 1.8232411E-01 -1.8561683E-01 -6.0057811E-02 8 7.7678550E+00 1.8504491E-02 -5.4178680E-01 -1.7100176E-01 9 3.4963440E+00 1.3809045E-03 -3.8184108E-01 -6.2352730E-02 10 1.3216892E+00 -1.7363864E-04 -5.6938715E-02 3.2068377E-01 11 4.8898474E-01 9.9096982E-05 3.4782159E-03 5.3021348E-01 12 1.5722790E-01 -3.4519268E-05 -1.3913082E-03 3.7668272E-01 4f- 1 3.0553627E+02 3.5954289E-03 2 1.0374563E+02 2.7441250E-02 3 4.2977330E+01 1.0670556E-01 4 1.9380492E+01 2.5466884E-01 5 8.9462673E+00 3.7181723E-01 6 4.0519492E+00 3.5501949E-01 7 1.7327633E+00 2.0355638E-01 8 6.4713929E-01 4.8247015E-02 4f+ 1 3.0553627E+02 3.1840625E-03 2 1.0374563E+02 2.5853333E-02 3 4.2977330E+01 1.0325285E-01 4 1.9380492E+01 2.4937666E-01 5 8.9462673E+00 3.6915401E-01 6 4.0519492E+00 3.5855288E-01 7 1.7327633E+00 2.1016227E-01 8 6.4713929E-01 5.2479550E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9752613E+07 2.9050225E-04 1.1056454E-04 5.2527325E-05 2.5906948E-05 1.0680936E-05 3.0929829E-06 2 1.0683831E+07 1.0459912E-03 3.9758186E-04 1.8917435E-04 9.3223974E-05 3.8431137E-05 1.1127642E-05 3 2.8539833E+06 2.4289776E-03 9.2561809E-04 4.3973765E-04 2.1691496E-04 8.9431730E-05 2.5898022E-05 4 8.4587464E+05 5.1855378E-03 1.9744319E-03 9.4009527E-04 4.6322374E-04 1.9096167E-04 5.5291271E-05 5 2.7341819E+05 1.0262987E-02 3.9283471E-03 1.8668392E-03 9.2122601E-04 3.7983456E-04 1.0999779E-04 6 9.4734216E+04 1.9275870E-02 7.3979560E-03 3.5291018E-03 1.7390937E-03 7.1697167E-04 2.0758839E-04 7 3.4877933E+04 3.4035527E-02 1.3275510E-02 6.3252953E-03 3.1247266E-03 1.2886422E-03 3.7320863E-04 8 1.3538220E+04 5.5686314E-02 2.2224419E-02 1.0684918E-02 5.2720805E-03 2.1742707E-03 6.2952938E-04 9 5.5062908E+03 8.0308631E-02 3.4216811E-02 1.6538892E-02 8.2065098E-03 3.3875894E-03 9.8130618E-04 10 2.3340177E+03 9.2569696E-02 4.4171280E-02 2.2005935E-02 1.0933511E-02 4.5170709E-03 1.3080204E-03 11 1.0270152E+03 6.8331642E-02 4.0510505E-02 2.0738516E-02 1.0486530E-02 4.3462775E-03 1.2602401E-03 12 4.6814112E+02 2.1785421E-02 4.2166366E-03 1.5748852E-03 5.8284427E-04 2.2454727E-04 6.3117498E-05 13 2.0745113E+02 1.2869143E-03 -4.3536038E-02 -3.6575643E-02 -2.0468815E-02 -8.6974774E-03 -2.5279285E-03 14 9.7146276E+01 -7.0513022E-06 -3.5081657E-02 -3.7994839E-02 -2.3841427E-02 -1.0413111E-02 -3.0447210E-03 15 4.0249039E+01 -7.2100875E-06 -4.3371263E-03 1.6936574E-02 1.7010095E-02 8.2555277E-03 2.4558863E-03 16 2.0964989E+01 3.3853647E-06 4.9330663E-04 2.4378241E-02 2.9720124E-02 1.5308993E-02 4.5776557E-03 17 8.5575880E+00 -1.3540035E-06 -1.1262244E-04 2.3745574E-03 -1.0296320E-02 -7.8814881E-03 -2.4759308E-03 18 4.2743559E+00 6.0005272E-07 3.7652580E-05 -2.0591455E-04 -1.1863338E-02 -1.1559408E-02 -3.9270899E-03 19 1.3054091E+00 -1.4241826E-07 -6.7145495E-06 3.1431091E-05 -4.9281656E-04 5.2406824E-03 2.4430018E-03 20 6.0905465E-01 5.4670407E-08 2.1092249E-06 -1.0093644E-05 7.5182781E-05 3.2484662E-03 2.0754669E-03 21 1.2346220E-01 -9.2948811E-09 -1.9463596E-07 1.0130365E-06 -6.5461346E-06 7.2944803E-05 -1.3396954E-03 22 4.5751293E-02 3.3960153E-09 3.5377972E-08 -2.3385393E-07 1.6201729E-06 -6.2909802E-06 -8.1002283E-04 2p- 3p- 4p- 5p- 1 5.2550019E+06 8.5658685E-05 4.3147214E-05 2.1073829E-05 8.0570528E-06 2 7.8796148E+05 2.9445065E-04 1.4843954E-04 7.2465362E-05 2.7751608E-05 3 1.6334535E+05 8.4437963E-04 4.2752130E-04 2.0912061E-04 7.9912800E-05 4 4.1240829E+04 2.2935918E-03 1.1644706E-03 5.6924497E-04 2.1822037E-04 5 1.2191800E+04 5.8750942E-03 3.0096192E-03 1.4764455E-03 5.6422376E-04 6 4.1315403E+03 1.3771075E-02 7.1262537E-03 3.4983206E-03 1.3430943E-03 7 1.5684536E+03 2.8099203E-02 1.4955393E-02 7.4050846E-03 2.8332400E-03 8 6.5069880E+02 4.5859948E-02 2.5425446E-02 1.2682096E-02 4.8931423E-03 9 2.8794482E+02 5.1297613E-02 3.0122918E-02 1.5314374E-02 5.8694068E-03 10 1.3335567E+02 2.9632724E-02 1.1824309E-02 4.9381049E-03 1.8886152E-03 11 6.1909723E+01 5.0810083E-03 -2.2565779E-02 -1.7049946E-02 -7.2875011E-03 12 3.0158261E+01 -3.6738124E-04 -2.6538490E-02 -2.1503138E-02 -8.9062852E-03 13 1.4509220E+01 -1.8344562E-04 -5.9742715E-03 6.2538494E-03 3.8603464E-03 14 6.8635602E+00 -1.4277625E-04 -1.1632519E-04 1.5777298E-02 1.0227824E-02 15 3.1952322E+00 -8.0284055E-05 -3.1769309E-05 3.9309676E-03 3.0770776E-04 16 1.2970608E+00 -4.3040378E-05 5.0003057E-06 7.7224477E-05 -6.6375742E-03 17 5.2039827E-01 -2.9441802E-05 -1.8667724E-06 -1.6134191E-06 -2.4598163E-03 18 1.1549167E-01 -1.2698877E-05 -1.3292660E-07 -2.4130160E-06 -6.6266459E-05 19 3.6565102E-02 -4.1658811E-06 -1.2561017E-07 -6.0311013E-07 6.4267530E-06 2p+ 3p+ 4p+ 5p+ 1 5.2550019E+06 3.4820799E-06 1.8084016E-06 8.9105043E-07 3.2847040E-07 2 7.8796148E+05 2.7387216E-05 1.4094433E-05 6.8464707E-06 2.5680062E-06 3 1.6334535E+05 1.5762661E-04 8.1689403E-05 4.0084701E-05 1.4854350E-05 4 4.1240829E+04 7.2969492E-04 3.7701076E-04 1.8378351E-04 6.8685387E-05 5 1.2191800E+04 2.7379249E-03 1.4250606E-03 6.9895128E-04 2.5963451E-04 6 4.1315403E+03 8.3778077E-03 4.3922610E-03 2.1501478E-03 8.0328469E-04 7 1.5684536E+03 2.0644586E-02 1.1109233E-02 5.4909740E-03 2.0437757E-03 8 6.5069880E+02 3.9275164E-02 2.2017323E-02 1.0951137E-02 4.1069045E-03 9 2.8794482E+02 5.1024218E-02 3.0636526E-02 1.5591834E-02 5.8270078E-03 10 1.3335567E+02 3.5854196E-02 1.9084211E-02 9.1656468E-03 3.4535627E-03 11 6.1909723E+01 8.7973248E-03 -1.5370967E-02 -1.1964945E-02 -4.9848983E-03 12 3.0158261E+01 9.6329618E-05 -2.8113512E-02 -2.3097498E-02 -9.3887746E-03 13 1.4509220E+01 9.6254118E-05 -8.3652314E-03 1.1348215E-03 1.1751105E-03 14 6.8635602E+00 -3.8103997E-05 -2.8575903E-04 1.5706513E-02 9.5479803E-03 15 3.1952322E+00 1.1550288E-05 -4.1857355E-05 5.4004201E-03 2.3336005E-03 16 1.2970608E+00 -2.9690326E-06 8.8843190E-06 1.9705503E-04 -5.8269969E-03 17 5.2039827E-01 6.7070177E-07 -1.8700839E-06 1.5460616E-06 -3.1832782E-03 18 1.1549167E-01 -7.8077010E-08 2.4187430E-07 -1.8760059E-07 -1.3928261E-04 19 3.6565102E-02 1.5766904E-08 -5.1185146E-08 3.7865005E-08 1.5635973E-05 3d- 4d- 5d- 1 3.8353473E+03 6.0188254E-04 3.0356234E-04 7.9156990E-05 2 1.0424122E+03 3.0916862E-03 1.5689797E-03 4.0511472E-04 3 3.8131805E+02 9.9890049E-03 5.1349300E-03 1.3417876E-03 4 1.6046367E+02 2.1942390E-02 1.1509711E-02 2.9858913E-03 5 7.3027673E+01 3.0469497E-02 1.5885839E-02 4.1784299E-03 6 3.4678608E+01 2.2956928E-02 9.2781692E-03 2.1990067E-03 7 1.6573904E+01 6.5842206E-03 -8.2850493E-03 -2.7146154E-03 8 7.7678550E+00 4.0460546E-04 -1.4712116E-02 -4.7958465E-03 9 3.4963440E+00 1.3180805E-05 -6.4847041E-03 -8.4909532E-04 10 1.3216892E+00 -5.3207165E-06 -5.4147262E-04 3.8837142E-03 11 4.8898474E-01 -2.6874264E-07 1.9850021E-05 3.5928187E-03 12 1.5722790E-01 -4.5025384E-07 -4.1633364E-06 1.3054732E-03 3d+ 4d+ 5d+ 1 3.8353473E+03 4.4408320E-04 2.2291180E-04 5.6615043E-05 2 1.0424122E+03 2.6070287E-03 1.3174758E-03 3.3109496E-04 3 3.8131805E+02 9.0728517E-03 4.6420894E-03 1.1800594E-03 4 1.6046367E+02 2.0843994E-02 1.0897895E-02 2.7536398E-03 5 7.3027673E+01 3.0016724E-02 1.5660994E-02 4.0070859E-03 6 3.4678608E+01 2.3609494E-02 9.9542041E-03 2.3452479E-03 7 1.6573904E+01 7.1754907E-03 -7.2796815E-03 -2.3552407E-03 8 7.7678550E+00 4.9817322E-04 -1.4574149E-02 -4.5992156E-03 9 3.4963440E+00 2.5140300E-05 -6.8934175E-03 -1.1258020E-03 10 1.3216892E+00 -2.0011391E-06 -6.3209795E-04 3.5586871E-03 11 4.8898474E-01 6.9704220E-07 2.3502321E-05 3.5791553E-03 12 1.5722790E-01 -1.4019228E-07 -5.3314038E-06 1.4418657E-03 4f- 1 3.0553627E+02 6.4105328E-04 2 1.0374563E+02 2.9940709E-03 3 4.2977330E+01 7.5914480E-03 4 1.9380492E+01 1.2229047E-02 5 8.9462673E+00 1.2154225E-02 6 4.0519492E+00 7.8167312E-03 7 1.7327633E+00 2.9314986E-03 8 6.4713929E-01 4.2452869E-04 4f+ 1 3.0553627E+02 5.9260471E-04 2 1.0374563E+02 2.8542244E-03 3 4.2977330E+01 7.3802625E-03 4 1.9380492E+01 1.2000820E-02 5 8.9462673E+00 1.2080536E-02 6 4.0519492E+00 7.8994168E-03 7 1.7327633E+00 3.0281961E-03 8 6.4713929E-01 4.6213004E-04 ** Os ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9734245E+07 2.1953594E-04 8.4131648E-05 4.0084402E-05 1.9831708E-05 8.2831956E-06 2.4164808E-06 2 1.0785365E+07 6.1290377E-04 2.3583141E-04 1.1248322E-04 5.5648728E-05 2.3243628E-05 6.7807654E-06 3 2.9044775E+06 1.4962428E-03 5.7963525E-04 2.7659112E-04 1.3691197E-04 5.7190473E-05 1.6684821E-05 4 8.6596117E+05 3.4505201E-03 1.3483417E-03 6.4487016E-04 3.1918494E-04 1.3333615E-04 3.8897700E-05 5 2.8114397E+05 7.8864847E-03 3.1248813E-03 1.4958658E-03 7.4121660E-04 3.0968395E-04 9.0352872E-05 6 9.7711772E+04 1.8027717E-02 7.2482534E-03 3.4843179E-03 1.7260089E-03 7.2119356E-04 2.1039128E-04 7 3.6049748E+04 4.1013216E-02 1.6896033E-02 8.1321504E-03 4.0370114E-03 1.6873072E-03 4.9233906E-04 8 1.4011562E+04 9.0550264E-02 3.8435412E-02 1.8663150E-02 9.2606394E-03 3.8713125E-03 1.1293712E-03 9 5.7030543E+03 1.8275940E-01 8.2912935E-02 4.0509138E-02 2.0204301E-02 8.4528769E-03 2.4670784E-03 10 2.4182154E+03 3.0184039E-01 1.5294791E-01 7.6892887E-02 3.8408226E-02 1.6084503E-02 4.6928014E-03 11 1.0641369E+03 3.2393693E-01 2.0167337E-01 1.0391139E-01 5.2762793E-02 2.2156823E-02 6.4732253E-03 12 4.8510058E+02 1.5136305E-01 2.5905025E-02 7.4804466E-03 2.0447778E-03 7.1956088E-04 1.9364038E-04 13 2.1499882E+02 1.3684401E-02 -4.7864011E-01 -4.0693430E-01 -2.2920554E-01 -9.8788640E-02 -2.8934807E-02 14 1.0070916E+02 -1.6193395E-04 -5.5902085E-01 -6.0995087E-01 -3.8431765E-01 -1.7013544E-01 -5.0140946E-02 15 4.1833730E+01 -1.2706180E-04 -1.0838710E-01 4.1971050E-01 4.2515213E-01 2.0942593E-01 6.2846289E-02 16 2.1807054E+01 7.6612906E-05 1.7150756E-02 8.4297373E-01 1.0329431E+00 5.4069843E-01 1.6311036E-01 17 8.9389640E+00 -4.8355838E-05 -6.2992027E-03 1.3089560E-01 -5.4645687E-01 -4.2771557E-01 -1.3584146E-01 18 4.4871736E+00 3.0408204E-05 3.0445719E-03 -1.6197177E-02 -9.1753889E-01 -9.0998140E-01 -3.1311808E-01 19 1.3912146E+00 -1.1192063E-05 -1.0267085E-03 4.5139330E-03 -7.0179831E-02 7.3541697E-01 3.5282891E-01 20 6.5039440E-01 5.2910699E-06 4.8950946E-04 -2.1264720E-03 1.5281849E-02 6.6109925E-01 4.1617828E-01 21 1.3307065E-01 -1.3135986E-06 -1.1876537E-04 4.8711194E-04 -2.9057950E-03 3.2925373E-02 -5.9947986E-01 22 4.8637271E-02 5.3049076E-07 4.7979597E-05 -1.9302940E-04 1.1615189E-03 -4.4653096E-03 -6.0404606E-01 2p- 3p- 4p- 5p- 1 5.6818230E+06 2.6250774E-04 1.3230792E-04 6.4847747E-05 2.5221205E-05 2 8.5793427E+05 7.9265261E-04 3.9964593E-04 1.9588020E-04 7.6193711E-05 3 1.7824400E+05 2.1134339E-03 1.0668804E-03 5.2315076E-04 2.0344972E-04 4 4.4966509E+04 5.3805244E-03 2.7234853E-03 1.3358117E-03 5.1990679E-04 5 1.3247718E+04 1.3982621E-02 7.1317011E-03 3.5068874E-03 1.3635627E-03 6 4.4671193E+03 3.7933178E-02 1.9592741E-02 9.6497242E-03 3.7635200E-03 7 1.6873571E+03 1.0147657E-01 5.3879843E-02 2.6766502E-02 1.0415495E-02 8 6.9704165E+02 2.3383867E-01 1.2930648E-01 6.4674274E-02 2.5359532E-02 9 3.0741088E+02 3.8289519E-01 2.2344188E-01 1.1395263E-01 4.4409964E-02 10 1.4203009E+02 3.3284355E-01 1.3887695E-01 5.9644837E-02 2.3230012E-02 11 6.6063728E+01 9.5992333E-02 -3.3062302E-01 -2.5174485E-01 -1.0967971E-01 12 3.2173567E+01 6.4315368E-04 -5.9677011E-01 -4.8951987E-01 -2.0690347E-01 13 1.5580040E+01 1.7152415E-03 -2.0701601E-01 1.6832365E-01 1.0939969E-01 14 7.3437668E+00 -9.5491086E-04 -7.7850332E-03 7.4480080E-01 4.9317357E-01 15 3.4327942E+00 3.9849154E-04 -1.7404790E-03 2.8746654E-01 3.8328006E-02 16 1.3912969E+00 -1.5836337E-04 5.3319232E-04 1.0564674E-02 -7.2377157E-01 17 5.5845512E-01 5.7308830E-05 -1.6302288E-04 3.9494498E-04 -4.1757091E-01 18 1.2308776E-01 -1.4140812E-05 4.5007831E-05 -9.1464423E-05 -2.3122797E-02 19 3.8312312E-02 5.2592680E-06 -1.6559320E-05 3.1348051E-05 4.0673855E-03 2p+ 3p+ 4p+ 5p+ 1 5.6818230E+06 1.5416169E-06 8.0084789E-07 3.9440073E-07 1.4901446E-07 2 8.5793427E+05 1.3980036E-05 7.2585265E-06 3.5555632E-06 1.3515073E-06 3 1.7824400E+05 1.0207246E-04 5.3261529E-05 2.6248350E-05 9.9234091E-06 4 4.4966509E+04 6.5590544E-04 3.4272886E-04 1.6820848E-04 6.3925908E-05 5 1.3247718E+04 3.6532027E-03 1.9225363E-03 9.4898881E-04 3.5908654E-04 6 4.4671193E+03 1.7066720E-02 9.0563295E-03 4.4620093E-03 1.6966086E-03 7 1.6873571E+03 6.4360884E-02 3.4986600E-02 1.7404458E-02 6.5962475E-03 8 6.9704165E+02 1.8591117E-01 1.0515207E-01 5.2588657E-02 2.0072589E-02 9 3.0741088E+02 3.6438660E-01 2.2004827E-01 1.1261881E-01 4.2851897E-02 10 1.4203009E+02 3.8594131E-01 2.1184704E-01 1.0301357E-01 3.9518121E-02 11 6.6063728E+01 1.4643050E-01 -2.1481907E-01 -1.7001178E-01 -7.2374370E-02 12 3.2173567E+01 3.8120619E-03 -6.2607482E-01 -5.1834683E-01 -2.1497034E-01 13 1.5580040E+01 3.0761866E-03 -2.8924196E-01 -3.0766036E-03 1.9464279E-02 14 7.3437668E+00 -1.7738482E-03 -1.8113321E-02 7.3045983E-01 4.5337026E-01 15 3.4327942E+00 7.9333495E-04 -2.3419309E-03 3.9344350E-01 1.8409309E-01 16 1.3912969E+00 -3.2028709E-04 7.6515986E-04 2.4408334E-02 -6.3263380E-01 17 5.5845512E-01 1.1553881E-04 -2.4547640E-04 1.9042419E-05 -5.4471331E-01 18 1.2308776E-01 -2.8833789E-05 6.8916413E-05 -1.6563287E-06 -4.9439052E-02 19 3.8312312E-02 1.0716442E-05 -2.5433106E-05 1.1872496E-06 9.8278420E-03 3d- 4d- 5d- 1 4.0203275E+03 1.6357958E-03 8.3037287E-04 2.2711640E-04 2 1.0896233E+03 1.1529311E-02 5.8934418E-03 1.6004952E-03 3 3.9795358E+02 5.5770054E-02 2.8874631E-02 7.9307196E-03 4 1.6732924E+02 1.8230296E-01 9.6316202E-02 2.6268218E-02 5 7.6144924E+01 3.7180698E-01 1.9522035E-01 5.3990729E-02 6 3.6176573E+01 4.0707280E-01 1.6647496E-01 4.1444375E-02 7 1.7315339E+01 1.7128624E-01 -2.0847278E-01 -7.2376127E-02 8 8.1348297E+00 1.6457132E-02 -5.4775696E-01 -1.8912450E-01 9 3.6854760E+00 1.2599614E-03 -3.5988935E-01 -4.8505679E-02 10 1.4115187E+00 -1.9094285E-04 -4.8979843E-02 3.6641555E-01 11 5.2982386E-01 9.5973595E-05 2.7168580E-03 5.3220926E-01 12 1.7280246E-01 -3.4587916E-05 -1.1336367E-03 3.2017145E-01 3d+ 4d+ 5d+ 1 4.0203275E+03 8.3648725E-04 4.2389009E-04 1.1308791E-04 2 1.0896233E+03 8.6819693E-03 4.4298176E-03 1.1700693E-03 3 3.9795358E+02 4.8516995E-02 2.5051048E-02 6.6931936E-03 4 1.6732924E+02 1.7008945E-01 8.9742629E-02 2.3830381E-02 5 7.6144924E+01 3.6301131E-01 1.9114283E-01 5.1413636E-02 6 3.6176573E+01 4.1650098E-01 1.7814842E-01 4.4094887E-02 7 1.7315339E+01 1.8529913E-01 -1.8194802E-01 -6.2411164E-02 8 8.1348297E+00 1.9301525E-02 -5.4207330E-01 -1.8113113E-01 9 3.6854760E+00 1.3727955E-03 -3.8284470E-01 -6.5192355E-02 10 1.4115187E+00 -1.8157792E-04 -5.7138110E-02 3.3552220E-01 11 5.2982386E-01 9.8083633E-05 3.3098367E-03 5.3133136E-01 12 1.7280246E-01 -3.5986164E-05 -1.3977684E-03 3.5760223E-01 4f- 1 3.2895741E+02 3.3711208E-03 2 1.1170925E+02 2.6014871E-02 3 4.6403320E+01 1.0261207E-01 4 2.0995110E+01 2.4945420E-01 5 9.7515337E+00 3.7092452E-01 6 4.4574969E+00 3.5817663E-01 7 1.9313762E+00 2.0416909E-01 8 7.3285164E-01 4.7290788E-02 4f+ 1 3.2895741E+02 2.9667424E-03 2 1.1170925E+02 2.4441768E-02 3 4.6403320E+01 9.9178726E-02 4 2.0995110E+01 2.4417648E-01 5 9.7515337E+00 3.6815002E-01 6 4.4574969E+00 3.6176715E-01 7 1.9313762E+00 2.1068587E-01 8 7.3285164E-01 5.1265139E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 4.9734245E+07 3.0238508E-04 1.1560954E-04 5.5024496E-05 2.7228968E-05 1.1372791E-05 3.3179567E-06 2 1.0785365E+07 1.0864427E-03 4.1483960E-04 1.9773874E-04 9.7771719E-05 4.0834309E-05 1.1911805E-05 3 2.9044775E+06 2.5083610E-03 9.6022390E-04 4.5701582E-04 2.2618830E-04 9.4474261E-05 2.7562863E-05 4 8.6596117E+05 5.3298364E-03 2.0386896E-03 9.7242429E-04 4.8076649E-04 2.0079329E-04 5.8572188E-05 5 2.8114397E+05 1.0501922E-02 4.0381868E-03 1.9225948E-03 9.5189279E-04 3.9760753E-04 1.1600610E-04 6 9.7711772E+04 1.9652292E-02 7.5769702E-03 3.6209277E-03 1.7903704E-03 7.4780126E-04 2.1813156E-04 7 3.6049748E+04 3.4590942E-02 1.3551975E-02 6.4690592E-03 3.2063409E-03 1.3395663E-03 3.9086061E-04 8 1.4011562E+04 5.6456517E-02 2.2625026E-02 1.0896265E-02 5.3945837E-03 2.2540434E-03 6.5749947E-04 9 5.7030543E+03 8.1297351E-02 3.4748971E-02 1.6825985E-02 8.3763687E-03 3.5027940E-03 1.0222831E-03 10 2.4182154E+03 9.3736586E-02 4.4780452E-02 2.2339258E-02 1.1136609E-02 4.6617134E-03 1.3599842E-03 11 1.0641369E+03 6.9447244E-02 4.1023593E-02 2.1021872E-02 1.0661915E-02 4.4760616E-03 1.3076564E-03 12 4.8510058E+02 2.2365818E-02 4.3011217E-03 1.5670106E-03 5.7447926E-04 2.2431391E-04 6.3321071E-05 13 2.1499882E+02 1.3555403E-03 -4.4118358E-02 -3.7124586E-02 -2.0862016E-02 -8.9870565E-03 -2.6320267E-03 14 1.0070916E+02 -1.0230070E-05 -3.5742278E-02 -3.8728653E-02 -2.4380619E-02 -1.0790935E-02 -3.1801255E-03 15 4.1833730E+01 -6.3296685E-06 -4.4692211E-03 1.7057765E-02 1.7239794E-02 8.4875856E-03 2.5469022E-03 16 2.1807054E+01 3.0455887E-06 5.0522409E-04 2.4937665E-02 3.0504170E-02 1.5964457E-02 4.8157750E-03 17 8.9389640E+00 -1.2864599E-06 -1.1695612E-04 2.4754498E-03 -1.0317424E-02 -8.0698702E-03 -2.5626214E-03 18 4.4871736E+00 5.8938156E-07 3.9452178E-05 -2.1540196E-04 -1.2288583E-02 -1.2183175E-02 -4.1920659E-03 19 1.3912146E+00 -1.4429669E-07 -7.1042766E-06 3.3033377E-05 -5.2368725E-04 5.4813236E-03 2.6295374E-03 20 6.5039440E-01 5.5751309E-08 2.2107013E-06 -1.0523897E-05 7.8058598E-05 3.3698298E-03 2.1212383E-03 21 1.3307065E-01 -9.6761521E-09 -2.0124865E-07 1.0436028E-06 -6.7328533E-06 7.5874540E-05 -1.3820192E-03 22 4.8637271E-02 3.5405346E-09 3.5173161E-08 -2.3446846E-07 1.6325616E-06 -6.2092965E-06 -8.4187962E-04 2p- 3p- 4p- 5p- 1 5.6818230E+06 8.7402022E-05 4.4115251E-05 2.1636408E-05 8.4108109E-06 2 8.5793427E+05 2.9856330E-04 1.5084860E-04 7.3934342E-05 2.8787705E-05 3 1.7824400E+05 8.4865098E-04 4.3049556E-04 2.1146949E-04 8.2166289E-05 4 4.4966509E+04 2.2858178E-03 1.1631492E-03 5.7080968E-04 2.2248058E-04 5 1.3247718E+04 5.8255860E-03 2.9894050E-03 1.4728471E-03 5.7229178E-04 6 4.4671193E+03 1.3639352E-02 7.0717136E-03 3.4845237E-03 1.3601739E-03 7 1.6873571E+03 2.7925664E-02 1.4870491E-02 7.3937676E-03 2.8763122E-03 8 6.9704165E+02 4.5999706E-02 2.5509384E-02 1.2764321E-02 5.0068743E-03 9 3.0741088E+02 5.2404861E-02 3.0745054E-02 1.5699537E-02 6.1189596E-03 10 1.4203009E+02 3.1255466E-02 1.3221067E-02 5.7103501E-03 2.2281816E-03 11 6.6063728E+01 5.6928906E-03 -2.1907787E-02 -1.6609904E-02 -7.2319565E-03 12 3.2173567E+01 -3.6080113E-04 -2.7655621E-02 -2.2655266E-02 -9.5752539E-03 13 1.5580040E+01 -1.9725524E-04 -6.6874287E-03 5.3735250E-03 3.4978876E-03 14 7.3437668E+00 -1.5403923E-04 -1.7523502E-04 1.6448242E-02 1.0893147E-02 15 3.4327942E+00 -8.5913045E-05 -2.8297863E-05 4.3326536E-03 5.7699021E-04 16 1.3912969E+00 -4.6629679E-05 4.1990886E-06 9.4293394E-05 -6.9663359E-03 17 5.5845512E-01 -3.1664717E-05 -1.6640099E-06 -2.7806318E-06 -2.5468998E-03 18 1.2308776E-01 -1.3762973E-05 -1.5801802E-07 -2.5030456E-06 -6.6539122E-05 19 3.8312312E-02 -4.4287156E-06 -1.1906789E-07 -6.7044972E-07 6.3794951E-06 2p+ 3p+ 4p+ 5p+ 1 5.6818230E+06 3.3413652E-06 1.7382872E-06 8.6173679E-07 3.2325973E-07 2 8.5793427E+05 2.6081169E-05 1.3475223E-05 6.5678641E-06 2.5070126E-06 3 1.7824400E+05 1.4982061E-04 7.7826812E-05 3.8390482E-05 1.4477522E-05 4 4.4966509E+04 6.9485449E-04 3.6022775E-04 1.7630008E-04 6.7049802E-05 5 1.3247718E+04 2.6242500E-03 1.3691343E-03 6.7478038E-04 2.5508513E-04 6 4.4671193E+03 8.1015146E-03 4.2586780E-03 2.0931764E-03 7.9574042E-04 7 1.6873571E+03 2.0184671E-02 1.0873341E-02 5.3985378E-03 2.0448725E-03 8 6.9704165E+02 3.8965541E-02 2.1858628E-02 1.0911250E-02 4.1634061E-03 9 3.0741088E+02 5.1764798E-02 3.1047847E-02 1.5868367E-02 6.0360713E-03 10 1.4203009E+02 3.7661470E-02 2.0606190E-02 1.0024404E-02 3.8458573E-03 11 6.6063728E+01 9.7874465E-03 -1.4130268E-02 -1.1169541E-02 -4.7543440E-03 12 3.2173567E+01 1.7872423E-04 -2.8980792E-02 -2.3962013E-02 -9.9356812E-03 13 1.5580040E+01 9.9629891E-05 -9.3327304E-03 -1.1689907E-04 6.1669863E-04 14 7.3437668E+00 -3.9379088E-05 -4.0095781E-04 1.6149896E-02 1.0020391E-02 15 3.4327942E+00 1.2011172E-05 -3.5589539E-05 5.9495543E-03 2.7837316E-03 16 1.3912969E+00 -3.0716185E-06 7.4253543E-06 2.3501792E-04 -6.0878636E-03 17 5.5845512E-01 6.9640954E-07 -1.5158655E-06 1.0466584E-07 -3.3212546E-03 18 1.2308776E-01 -7.9739850E-08 2.0133861E-07 -2.1818718E-09 -1.4151355E-04 19 3.8312312E-02 1.5932763E-08 -4.2044914E-08 9.4562864E-10 1.5693035E-05 3d- 4d- 5d- 1 4.0203275E+03 6.0259289E-04 3.0614619E-04 8.3931129E-05 2 1.0896233E+03 3.0988620E-03 1.5844931E-03 4.3001388E-04 3 3.9795358E+02 1.0041651E-02 5.1995017E-03 1.4285084E-03 4 1.6732924E+02 2.2155907E-02 1.1709118E-02 3.1931946E-03 5 7.6144924E+01 3.0954768E-02 1.6265605E-02 4.4993245E-03 6 3.6176573E+01 2.3504166E-02 9.6333612E-03 2.3996893E-03 7 1.7315339E+01 6.8287298E-03 -8.3525200E-03 -2.8989654E-03 8 8.1348297E+00 4.3046368E-04 -1.5069404E-02 -5.2030733E-03 9 3.6854760E+00 1.2974664E-05 -6.6658183E-03 -8.9929141E-04 10 1.4115187E+00 -5.7504766E-06 -5.5994886E-04 4.2016057E-03 11 5.2982386E-01 -3.3576560E-07 1.9584219E-05 3.7394253E-03 12 1.7280246E-01 -5.0261448E-07 -4.3500144E-06 1.2847346E-03 3d+ 4d+ 5d+ 1 4.0203275E+03 4.4010572E-04 2.2255929E-04 5.9402371E-05 2 1.0896233E+03 2.5975929E-03 1.3228348E-03 3.4921043E-04 3 3.9795358E+02 9.0892135E-03 4.6849217E-03 1.2515007E-03 4 1.6732924E+02 2.1006104E-02 1.1067034E-02 2.9379642E-03 5 7.6144924E+01 3.0469963E-02 1.6026324E-02 4.3101487E-03 6 3.6176573E+01 2.4179644E-02 1.0341069E-02 2.5601097E-03 7 1.7315339E+01 7.4542199E-03 -7.2926053E-03 -2.5013222E-03 8 8.1348297E+00 5.3179203E-04 -1.4922113E-02 -4.9852768E-03 9 3.6854760E+00 2.5674674E-05 -7.0960833E-03 -1.2085278E-03 10 1.4115187E+00 -2.1647389E-06 -6.5552617E-04 3.8477857E-03 11 5.2982386E-01 7.2066555E-07 2.3282174E-05 3.7334789E-03 12 1.7280246E-01 -1.5346440E-07 -5.6154540E-06 1.4350253E-03 4f- 1 3.2895741E+02 6.2052130E-04 2 1.1170925E+02 2.9403045E-03 3 4.6403320E+01 7.5802065E-03 4 2.0995110E+01 1.2463840E-02 5 9.7515337E+00 1.2657218E-02 6 4.4574969E+00 8.2709656E-03 7 1.9313762E+00 3.1041056E-03 8 7.3285164E-01 4.4275996E-04 4f+ 1 3.2895741E+02 5.7184785E-04 2 1.1170925E+02 2.7978781E-03 3 4.6403320E+01 7.3636361E-03 4 2.0995110E+01 1.2228525E-02 5 9.7515337E+00 1.2577607E-02 6 4.4574969E+00 8.3594697E-03 7 1.9313762E+00 3.2050273E-03 8 7.3285164E-01 4.8040445E-04 ** Ir ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0217253E+07 2.3083314E-04 8.8868222E-05 4.2416164E-05 2.1055453E-05 8.9014822E-06 2.6092215E-06 2 1.0978438E+07 6.4000957E-04 2.4740363E-04 1.1821129E-04 5.8678614E-05 2.4808048E-05 7.2716240E-06 3 2.9762744E+06 1.5511966E-03 6.0372357E-04 2.8860235E-04 1.4333497E-04 6.0602932E-05 1.7764571E-05 4 8.9166997E+05 3.5498674E-03 1.3937314E-03 6.6776611E-04 3.3162997E-04 1.4022551E-04 4.1102470E-05 5 2.9050708E+05 8.0501037E-03 3.2051500E-03 1.5371286E-03 7.6421170E-04 3.2318060E-04 9.4739694E-05 6 1.0120331E+05 1.8256566E-02 7.3774002E-03 3.5528805E-03 1.7659511E-03 7.4690107E-04 2.1893009E-04 7 3.7393207E+04 4.1230524E-02 1.7073979E-02 8.2338204E-03 4.1011982E-03 1.7350036E-03 5.0866797E-04 8 1.4545231E+04 9.0482352E-02 3.8605106E-02 1.8780077E-02 9.3506473E-03 3.9568292E-03 1.1598312E-03 9 5.9219685E+03 1.8189615E-01 8.2883306E-02 4.0572004E-02 2.0302994E-02 8.5974055E-03 2.5212197E-03 10 2.5108681E+03 3.0014456E-01 1.5242820E-01 7.6738885E-02 3.8462011E-02 1.6305227E-02 4.7799816E-03 11 1.1046228E+03 3.2336130E-01 2.0079535E-01 1.0356090E-01 5.2742844E-02 2.2414429E-02 6.5796869E-03 12 5.0348250E+02 1.5291074E-01 2.6536321E-02 7.5309294E-03 2.0627478E-03 7.4100693E-04 2.0060453E-04 13 2.2300069E+02 1.4255814E-02 -4.7607938E-01 -4.0536426E-01 -2.2925954E-01 -1.0008823E-01 -2.9462043E-02 14 1.0444928E+02 -2.3247183E-04 -5.5981220E-01 -6.1109549E-01 -3.8623852E-01 -1.7310763E-01 -5.1274775E-02 15 4.3481712E+01 -8.7735504E-05 -1.0974808E-01 4.1378646E-01 4.2188752E-01 2.1061860E-01 6.3564087E-02 16 2.2682356E+01 5.2826232E-05 1.7271654E-02 8.4593922E-01 1.0399438E+00 5.5258181E-01 1.6773795E-01 17 9.3324404E+00 -3.7459513E-05 -6.4202644E-03 1.3361109E-01 -5.3535984E-01 -4.2808216E-01 -1.3713817E-01 18 4.7082932E+00 2.5167489E-05 3.1236235E-03 -1.6578593E-02 -9.2752140E-01 -9.3456246E-01 -3.2452219E-01 19 1.4803329E+00 -9.3479149E-06 -1.0539934E-03 4.5970363E-03 -7.2128226E-02 7.4450737E-01 3.6543962E-01 20 6.9266441E-01 4.3440476E-06 4.9716083E-04 -2.1436250E-03 1.5304867E-02 6.6375857E-01 4.1116387E-01 21 1.4246950E-01 -1.0702122E-06 -1.1898636E-04 4.8353557E-04 -2.8725443E-03 3.2847062E-02 -5.9618815E-01 22 5.1417865E-02 4.2705693E-07 4.7470786E-05 -1.8886570E-04 1.1355272E-03 -4.3089496E-03 -6.0761191E-01 2p- 3p- 4p- 5p- 1 6.1541358E+06 2.6511637E-04 1.3390088E-04 6.5896498E-05 2.6024347E-05 2 9.3548689E+05 7.9792242E-04 4.0314263E-04 1.9839821E-04 7.8363009E-05 3 1.9476704E+05 2.1154400E-03 1.0700293E-03 5.2683928E-04 2.0804545E-04 4 4.9096632E+04 5.3439050E-03 2.7103059E-03 1.3346678E-03 5.2745785E-04 5 1.4415854E+04 1.3742595E-02 7.0201660E-03 3.4661415E-03 1.3685400E-03 6 4.8367812E+03 3.6890872E-02 1.9083820E-02 9.4345065E-03 3.7360885E-03 7 1.8176265E+03 9.8244680E-02 5.2178598E-02 2.6025669E-02 1.0283538E-02 8 7.4754548E+02 2.2755563E-01 1.2584119E-01 6.3141422E-02 2.5137176E-02 9 3.2854050E+02 3.7896955E-01 2.2088490E-01 1.1312543E-01 4.4775276E-02 10 1.5142785E+02 3.4005617E-01 1.4940278E-01 6.6042071E-02 2.6193799E-02 11 7.0586341E+01 1.0360179E-01 -3.0833651E-01 -2.3585738E-01 -1.0456713E-01 12 3.4350220E+01 1.5593487E-03 -6.0108470E-01 -4.9795381E-01 -2.1443059E-01 13 1.6728933E+01 1.7041129E-03 -2.2359160E-01 1.3342684E-01 9.2950519E-02 14 7.8478932E+00 -9.4824240E-04 -1.0631219E-02 7.4940147E-01 5.0619002E-01 15 3.6808377E+00 3.9633960E-04 -1.3841833E-03 3.0461171E-01 5.5435190E-02 16 1.4887244E+00 -1.5652128E-04 4.1294508E-04 1.2138806E-02 -7.3272535E-01 17 5.9750705E-01 5.6892116E-05 -1.1760799E-04 2.4625206E-04 -4.1753088E-01 18 1.3059943E-01 -1.3768299E-05 3.4052584E-05 -5.4039866E-05 -2.2455357E-02 19 3.9996623E-02 5.0780588E-06 -1.2364392E-05 1.7919829E-05 3.9535114E-03 2p+ 3p+ 4p+ 5p+ 1 6.1541358E+06 1.4870559E-06 7.7441866E-07 3.8327409E-07 1.4715234E-07 2 9.3548689E+05 1.3276039E-05 6.9162123E-06 3.4018546E-06 1.3138756E-06 3 1.9476704E+05 9.5804451E-05 5.0116122E-05 2.4818408E-05 9.5347901E-06 4 4.9096632E+04 6.1073145E-04 3.2017698E-04 1.5780134E-04 6.0935628E-05 5 1.4415854E+04 3.3989489E-03 1.7932069E-03 8.8939343E-04 3.4198763E-04 6 4.8367812E+03 1.5960577E-02 8.4933849E-03 4.2020961E-03 1.6234610E-03 7 1.8176265E+03 6.0782643E-02 3.3083965E-02 1.6532477E-02 6.3671857E-03 8 7.4754548E+02 1.7816672E-01 1.0086360E-01 5.0630590E-02 1.9633841E-02 9 3.2854050E+02 3.5733778E-01 2.1556910E-01 1.1079112E-01 4.2844242E-02 10 1.5142785E+02 3.9222788E-01 2.2072352E-01 1.0861741E-01 4.2361028E-02 11 7.0586341E+01 1.5762867E-01 -1.8755255E-01 -1.5146259E-01 -6.5842229E-02 12 3.4350220E+01 5.9931445E-03 -6.2291891E-01 -5.1864795E-01 -2.1904216E-01 13 1.6728933E+01 2.9910991E-03 -3.1113557E-01 -4.3554337E-02 6.1114327E-05 14 7.8478932E+00 -1.7277597E-03 -2.3562932E-02 7.2408792E-01 4.5809329E-01 15 3.6808377E+00 7.7508674E-04 -1.7307314E-03 4.1683724E-01 2.0831148E-01 16 1.4887244E+00 -3.1157963E-04 5.5041513E-04 2.7752827E-02 -6.3722878E-01 17 5.9750705E-01 1.1271522E-04 -1.6581423E-04 -2.2922526E-04 -5.4893240E-01 18 1.3059943E-01 -2.7625684E-05 4.9740051E-05 6.5108129E-05 -4.8719631E-02 19 3.9996623E-02 1.0181078E-05 -1.8116597E-05 -2.2059062E-05 9.6776566E-03 3d- 4d- 5d- 1 4.2102882E+03 1.6258861E-03 8.3132250E-04 2.3721762E-04 2 1.1379254E+03 1.1387816E-02 5.8642665E-03 1.6615550E-03 3 4.1492475E+02 5.5073792E-02 2.8719172E-02 8.2304852E-03 4 1.7431919E+02 1.8057677E-01 9.6110772E-02 2.7350772E-02 5 7.9313985E+01 3.7019679E-01 1.9587310E-01 5.6532543E-02 6 3.7698494E+01 4.0804308E-01 1.6907223E-01 4.3925025E-02 7 1.8068275E+01 1.7361660E-01 -2.0597145E-01 -7.5215780E-02 8 8.5082552E+00 1.7042197E-02 -5.4836409E-01 -1.9887326E-01 9 3.8794137E+00 1.2495303E-03 -3.5994505E-01 -4.9733187E-02 10 1.5055675E+00 -1.9961815E-04 -4.9006280E-02 3.8035001E-01 11 5.7171607E-01 9.5226223E-05 2.5144217E-03 5.3146751E-01 12 1.8858452E-01 -3.5818292E-05 -1.1190593E-03 3.0331478E-01 3d+ 4d+ 5d+ 1 4.2102882E+03 8.1501582E-04 4.1608783E-04 1.1575980E-04 2 1.1379254E+03 8.4902396E-03 4.3652612E-03 1.2022214E-03 3 4.1492475E+02 4.7670843E-02 2.4796458E-02 6.9090601E-03 4 1.7431919E+02 1.6804292E-01 8.9340008E-02 2.4739733E-02 5 7.9313985E+01 3.6103564E-01 1.9162933E-01 5.3763380E-02 6 3.7698494E+01 4.1755261E-01 1.8103208E-01 4.6747721E-02 7 1.8068275E+01 1.8810096E-01 -1.7861685E-01 -6.4498738E-02 8 8.5082552E+00 2.0056806E-02 -5.4246816E-01 -1.9030417E-01 9 3.8794137E+00 1.3648455E-03 -3.8346672E-01 -6.7729735E-02 10 1.5055675E+00 -1.8940721E-04 -5.7320729E-02 3.4803372E-01 11 5.7171607E-01 9.6893232E-05 3.0848146E-03 5.3166396E-01 12 1.8858452E-01 -3.7324565E-05 -1.3864416E-03 3.4237813E-01 4f- 1 3.5243167E+02 3.1872944E-03 2 1.1968147E+02 2.4823615E-02 3 4.9829894E+01 9.9172439E-02 4 2.2610022E+01 2.4497427E-01 5 1.0557352E+01 3.7017310E-01 6 4.8641964E+00 3.6093365E-01 7 2.1311820E+00 2.0451091E-01 8 8.1914535E-01 4.6343631E-02 4f+ 1 3.5243167E+02 2.7872960E-03 2 1.1968147E+02 2.3257267E-02 3 4.9829894E+01 9.5737164E-02 4 2.2610022E+01 2.3968700E-01 5 1.0557352E+01 3.6728986E-01 6 4.8641964E+00 3.6459096E-01 7 2.1311820E+00 2.1098984E-01 8 8.1914535E-01 5.0116931E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0217253E+07 3.1342969E-04 1.2038139E-04 5.7397868E-05 2.8497990E-05 1.2047708E-05 3.5315932E-06 2 1.0978438E+07 1.1237611E-03 4.3106037E-04 2.0582814E-04 1.0211323E-04 4.3168024E-05 1.2652570E-05 3 2.9762744E+06 2.5811703E-03 9.9263869E-04 4.7329026E-04 2.3502214E-04 9.9358453E-05 2.9125817E-05 4 8.9166997E+05 5.4614550E-03 2.0986788E-03 1.0027763E-03 4.9744083E-04 2.1029453E-04 6.1636053E-05 5 2.9050708E+05 1.0718727E-02 4.1405185E-03 1.9748776E-03 9.8102595E-04 4.1475979E-04 1.2158642E-04 6 1.0120331E+05 1.9992788E-02 7.7435135E-03 3.7068937E-03 1.8390618E-03 7.7752763E-04 2.2788379E-04 7 3.7393207E+04 3.5093918E-02 1.3809649E-02 6.6039801E-03 3.2840489E-03 1.3887026E-03 4.0712615E-04 8 1.4545231E+04 5.7163787E-02 2.3000471E-02 1.1095312E-02 5.5117049E-03 2.3311734E-03 6.8324218E-04 9 5.9219685E+03 8.2241193E-02 3.5256948E-02 1.7100713E-02 8.5409474E-03 3.6149382E-03 1.0600352E-03 10 2.5108681E+03 9.4937364E-02 4.5385049E-02 2.2667566E-02 1.1338158E-02 4.8044142E-03 1.4083202E-03 11 1.1046228E+03 7.0695168E-02 4.1591254E-02 2.1330483E-02 1.0850570E-02 4.6099154E-03 1.3531747E-03 12 5.0348250E+02 2.3057875E-02 4.4902878E-03 1.6190338E-03 5.9749457E-04 2.3733898E-04 6.7378064E-05 13 2.2300069E+02 1.4412614E-03 -4.4678930E-02 -3.7640248E-02 -2.1237068E-02 -9.2666119E-03 -2.7274534E-03 14 1.0444928E+02 -1.5292415E-05 -3.6460239E-02 -3.9515189E-02 -2.4952405E-02 -1.1180967E-02 -3.3117204E-03 15 4.3481712E+01 -4.7532095E-06 -4.6150492E-03 1.7139428E-02 1.7434221E-02 8.6987467E-03 2.6251197E-03 16 2.2682356E+01 2.3824087E-06 5.1883327E-04 2.5524539E-02 3.1321419E-02 1.6639432E-02 5.0507654E-03 17 9.3324404E+00 -1.1142004E-06 -1.2172277E-04 2.5820120E-03 -1.0327177E-02 -8.2517072E-03 -2.6430796E-03 18 4.7082932E+00 5.4053817E-07 4.1415693E-05 -2.2582984E-04 -1.2724925E-02 -1.2816936E-02 -4.4505333E-03 19 1.4803329E+00 -1.3830303E-07 -7.5071859E-06 3.4694215E-05 -5.5522461E-04 5.7240178E-03 2.8093705E-03 20 6.9266441E-01 5.4179935E-08 2.3084331E-06 -1.0943411E-05 8.0685888E-05 3.4916333E-03 2.1627239E-03 21 1.4246950E-01 -9.7647413E-09 -2.0645565E-07 1.0705357E-06 -6.8886027E-06 7.8319624E-05 -1.4221419E-03 22 5.1417865E-02 3.6222716E-09 3.4627787E-08 -2.3497971E-07 1.6417761E-06 -6.1594359E-06 -8.7071992E-04 2p- 3p- 4p- 5p- 1 6.1541358E+06 8.9100537E-05 4.5061411E-05 2.2191972E-05 8.7599419E-06 2 9.3548689E+05 3.0252092E-04 1.5318020E-04 7.5374947E-05 2.9800455E-05 3 1.9476704E+05 8.5249005E-04 4.3322639E-04 2.1370748E-04 8.4318898E-05 4 4.9096632E+04 2.2767563E-03 1.1610911E-03 5.7200912E-04 2.2638079E-04 5 1.4415854E+04 5.7719965E-03 2.9667460E-03 1.4679300E-03 5.7919392E-04 6 4.8367812E+03 1.3495693E-02 7.0104273E-03 3.4672077E-03 1.3742498E-03 7 1.8176265E+03 2.7722806E-02 1.4768534E-02 7.3734212E-03 2.9126514E-03 8 7.4754548E+02 4.6087384E-02 2.5562852E-02 1.2831559E-02 5.1103288E-03 9 3.2854050E+02 5.3480725E-02 3.1338774E-02 1.6070958E-02 6.3614006E-03 10 1.5142785E+02 3.2950119E-02 1.4677589E-02 6.5222088E-03 2.5913182E-03 11 7.0586341E+01 6.3857459E-03 -2.1116630E-02 -1.6077242E-02 -7.1228670E-03 12 3.4350220E+01 -3.4371210E-04 -2.8780511E-02 -2.3807112E-02 -1.0251120E-02 13 1.6728933E+01 -2.1349260E-04 -7.4843428E-03 4.4018389E-03 3.0742742E-03 14 7.8478932E+00 -1.6588562E-04 -2.4622666E-04 1.7107186E-02 1.1557115E-02 15 3.6808377E+00 -9.1902110E-05 -2.3644132E-05 4.7544802E-03 8.6519645E-04 16 1.4887244E+00 -5.0424952E-05 3.1890044E-06 1.1281557E-04 -7.2953224E-03 17 5.9750705E-01 -3.3993108E-05 -1.4084247E-06 -4.0518676E-06 -2.6342288E-03 18 1.3059943E-01 -1.4874849E-05 -1.8469568E-07 -2.5961532E-06 -6.6587440E-05 19 3.9996623E-02 -4.6861004E-06 -1.1089781E-07 -7.3799820E-07 6.3293520E-06 2p+ 3p+ 4p+ 5p+ 1 6.1541358E+06 3.1992339E-06 1.6667609E-06 8.3134540E-07 3.1688643E-07 2 9.3548689E+05 2.4785393E-05 1.2857583E-05 6.2880472E-06 2.4389553E-06 3 1.9476704E+05 1.4212048E-04 7.3990289E-05 3.6690556E-05 1.4059815E-05 4 4.9096632E+04 6.6024792E-04 3.4345616E-04 1.6876123E-04 6.5216897E-05 5 1.4415854E+04 2.5096932E-03 1.3123642E-03 6.4993913E-04 2.4966635E-04 6 4.8367812E+03 7.8172912E-03 4.1201734E-03 2.0333188E-03 7.8540047E-04 7 1.8176265E+03 1.9695752E-02 1.0620581E-02 5.2966616E-03 2.0387053E-03 8 7.4754548E+02 3.8586979E-02 2.1660022E-02 1.0851179E-02 4.2065305E-03 9 3.2854050E+02 5.2430417E-02 3.1405945E-02 1.6117917E-02 6.2308926E-03 10 1.5142785E+02 3.9511453E-02 2.2152698E-02 1.0903515E-02 4.2525492E-03 11 7.0586341E+01 1.0892172E-02 -1.2731807E-02 -1.0271387E-02 -4.4648125E-03 12 3.4350220E+01 2.8987705E-04 -2.9789557E-02 -2.4768150E-02 -1.0458140E-02 13 1.6728933E+01 1.0050092E-04 -1.0403204E-02 -1.4726791E-03 -8.9087068E-06 14 7.8478932E+00 -3.9715209E-05 -5.3923253E-04 1.6548700E-02 1.0465919E-02 15 3.6808377E+00 1.2181923E-05 -2.7321985E-05 6.5271828E-03 3.2617282E-03 16 1.4887244E+00 -3.1024970E-06 5.5607707E-06 2.7641581E-04 -6.3431319E-03 17 5.9750705E-01 7.0674808E-07 -1.0723525E-06 -1.4563491E-06 -3.4620392E-03 18 1.3059943E-01 -7.9584541E-08 1.5250435E-07 1.9419485E-07 -1.4364646E-04 19 3.9996623E-02 1.5780335E-08 -3.1640614E-08 -3.6795450E-08 1.5789124E-05 3d- 4d- 5d- 1 4.2102882E+03 6.0375447E-04 3.0895910E-04 8.8375593E-05 2 1.1379254E+03 3.1079019E-03 1.6009550E-03 4.5328890E-04 3 4.1492475E+02 1.0098568E-02 5.2665871E-03 1.5097818E-03 4 1.7431919E+02 2.2374619E-02 1.1912402E-02 3.3897322E-03 5 7.9313985E+01 3.1440462E-02 1.6648506E-02 4.8060277E-03 6 3.7698494E+01 2.4045493E-02 9.9857854E-03 2.5959397E-03 7 1.8068275E+01 7.0693751E-03 -8.4286093E-03 -3.0770173E-03 8 8.5082552E+00 4.5583154E-04 -1.5427914E-02 -5.5952334E-03 9 3.8794137E+00 1.2744233E-05 -6.8398744E-03 -9.4606755E-04 10 1.5055675E+00 -6.2010808E-06 -5.7852519E-04 4.5042812E-03 11 5.7171607E-01 -4.1336013E-07 1.8900371E-05 3.8790128E-03 12 1.8858452E-01 -5.5617675E-07 -4.4679095E-06 1.2714453E-03 3d+ 4d+ 5d+ 1 4.2102882E+03 4.3643733E-04 2.2233070E-04 6.1883844E-05 2 1.1379254E+03 2.5895225E-03 1.3287705E-03 3.6573426E-04 3 4.1492475E+02 9.1087703E-03 4.7294617E-03 1.3175192E-03 4 1.7431919E+02 2.1171885E-02 1.1238943E-02 3.1113582E-03 5 7.9313985E+01 3.0922755E-02 1.6394378E-02 4.5988928E-03 6 3.7698494E+01 2.4744605E-02 1.0726660E-02 2.7704946E-03 7 1.8068275E+01 7.7300302E-03 -7.3119949E-03 -2.6402114E-03 8 8.5082552E+00 5.6517284E-04 -1.5271663E-02 -5.3564819E-03 9 3.8794137E+00 2.6204810E-05 -7.2923037E-03 -1.2882199E-03 10 1.5055675E+00 -2.3343553E-06 -6.7919015E-04 4.1220748E-03 11 5.7171607E-01 7.4216180E-07 2.2543596E-05 3.8807016E-03 12 1.8858452E-01 -1.6653509E-07 -5.8190375E-06 1.4353029E-03 4f- 1 3.5243167E+02 6.0421350E-04 2 1.1968147E+02 2.8990737E-03 3 4.9829894E+01 7.5863661E-03 4 2.2610022E+01 1.2698149E-02 5 1.0557352E+01 1.3141286E-02 6 4.8641964E+00 8.7060029E-03 7 2.1311820E+00 3.2660090E-03 8 8.1914535E-01 4.5866652E-04 4f+ 1 3.5243167E+02 5.5505497E-04 2 1.1968147E+02 2.7535238E-03 3 4.9829894E+01 7.3633261E-03 4 2.2610022E+01 1.2455010E-02 5 1.0557352E+01 1.3055752E-02 6 4.8641964E+00 8.8005510E-03 7 2.1311820E+00 3.3716166E-03 8 8.1914535E-01 4.9652780E-04 ** Pt ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0554041E+07 2.4308003E-04 9.4018077E-05 4.4951731E-05 2.2388290E-05 9.5723675E-06 2.8138231E-06 2 1.1143707E+07 6.6927484E-04 2.5992980E-04 1.2441070E-04 6.1961808E-05 2.6493644E-05 7.7877265E-06 3 3.0420913E+06 1.6103698E-03 6.2970642E-04 3.0155031E-04 1.5026380E-04 6.4253363E-05 1.8887981E-05 4 9.1604274E+05 3.6569642E-03 1.4426596E-03 6.9241260E-04 3.4502101E-04 1.4754599E-04 4.3371031E-05 5 2.9956850E+05 8.2280769E-03 3.2920427E-03 1.5816536E-03 7.8896838E-04 3.3743489E-04 9.9198425E-05 6 1.0462814E+05 1.8512344E-02 7.5190414E-03 3.6275728E-03 1.8091654E-03 7.7389026E-04 2.2748660E-04 7 3.8723387E+04 4.1498853E-02 1.7275573E-02 8.3469221E-03 4.1714334E-03 1.7847232E-03 5.2472529E-04 8 1.5077101E+04 9.0506181E-02 3.8818418E-02 1.8918047E-02 9.4514733E-03 4.0451558E-03 1.1891080E-03 9 6.1411452E+03 1.8116770E-01 8.2923970E-02 4.0667998E-02 2.0418630E-02 8.7442076E-03 2.5715149E-03 10 2.6039146E+03 2.9853900E-01 1.5198528E-01 7.6622511E-02 3.8533682E-02 1.6523042E-02 4.8577840E-03 11 1.1453476E+03 3.2264927E-01 1.9986206E-01 1.0317474E-01 5.2704642E-02 2.2648169E-02 6.6668873E-03 12 5.2197130E+02 1.5420789E-01 2.6777697E-02 7.3444971E-03 1.9501748E-03 7.0593363E-04 1.9123011E-04 13 2.3112078E+02 1.4775114E-02 -4.7377073E-01 -4.0406376E-01 -2.2945901E-01 -1.0138761E-01 -2.9937778E-02 14 1.0825551E+02 -2.9135163E-04 -5.6026751E-01 -6.1183635E-01 -3.8793893E-01 -1.7587894E-01 -5.2253972E-02 15 4.5166553E+01 -5.4255990E-05 -1.1097354E-01 4.0842885E-01 4.1917579E-01 2.1189338E-01 6.4175096E-02 16 2.3576687E+01 3.2580496E-05 1.7361554E-02 8.4851125E-01 1.0465140E+00 5.6403328E-01 1.7197079E-01 17 9.7353224E+00 -2.8086663E-05 -6.5292515E-03 1.3618114E-01 -5.2511318E-01 -4.2881002E-01 -1.3835429E-01 18 4.9359837E+00 2.0613884E-05 3.1965424E-03 -1.6944760E-02 -9.3685412E-01 -9.5786766E-01 -3.3479096E-01 19 1.5726304E+00 -7.7350371E-06 -1.0775016E-03 4.6678891E-03 -7.3939553E-02 7.5335991E-01 3.7663302E-01 20 7.3587053E-01 3.5224576E-06 5.0227165E-04 -2.1524034E-03 1.5264752E-02 6.6636309E-01 4.0597512E-01 21 1.5177204E-01 -8.6309907E-07 -1.1863531E-04 4.7829036E-04 -2.8314715E-03 3.2667649E-02 -5.9314700E-01 22 5.4134642E-02 3.4107851E-07 4.6832488E-05 -1.8450819E-04 1.1090426E-03 -4.1801087E-03 -6.1047268E-01 2p- 3p- 4p- 5p- 1 6.6448052E+06 2.6812285E-04 1.3569329E-04 6.7048689E-05 2.6856325E-05 2 1.0175399E+06 8.0438343E-04 4.0723152E-04 2.0121869E-04 8.0608117E-05 3 2.1240039E+05 2.1204121E-03 1.0746331E-03 5.3124646E-04 2.1277376E-04 4 5.3523591E+04 5.3156246E-03 2.7011576E-03 1.3354500E-03 5.3526542E-04 5 1.5669397E+04 1.3530178E-02 6.9221414E-03 3.4315193E-03 1.3741930E-03 6 5.2326705E+03 3.5936387E-02 1.8618077E-02 9.2388934E-03 3.7104632E-03 7 1.9565976E+03 9.5216140E-02 5.0584548E-02 2.5330499E-02 1.0151500E-02 8 8.0119731E+02 2.2148498E-01 1.2249395E-01 6.1659245E-02 2.4893367E-02 9 3.5091728E+02 3.7475431E-01 2.1813381E-01 1.1216942E-01 4.5035822E-02 10 1.6136672E+02 3.4666558E-01 1.5905923E-01 7.1988520E-02 2.9021611E-02 11 7.5381526E+01 1.1142140E-01 -2.8632161E-01 -2.2027365E-01 -9.9282020E-02 12 3.6636306E+01 2.6723954E-03 -6.0411814E-01 -5.0469281E-01 -2.2107888E-01 13 1.7921896E+01 1.6548923E-03 -2.4028670E-01 1.0027403E-01 7.6940673E-02 14 8.3625105E+00 -9.2443517E-04 -1.3640375E-02 7.5264587E-01 5.1800005E-01 15 3.9334461E+00 3.8698658E-04 -9.9927498E-04 3.2052623E-01 7.1207020E-02 16 1.5882407E+00 -1.5207819E-04 2.8743218E-04 1.3641145E-02 -7.4120546E-01 17 6.3724541E-01 5.5571365E-05 -7.0591925E-05 1.0606150E-04 -4.1714274E-01 18 1.3801485E-01 -1.3183750E-05 2.3036109E-05 -1.8980660E-05 -2.1751909E-02 19 4.1618396E-02 4.8266068E-06 -8.2308835E-06 5.5422469E-06 3.8367018E-03 2p+ 3p+ 4p+ 5p+ 1 6.6448052E+06 1.4392102E-06 7.5131229E-07 3.7366063E-07 1.4559041E-07 2 1.0175399E+06 1.2644629E-05 6.6093087E-06 3.2643761E-06 1.2793798E-06 3 2.1240039E+05 9.0169771E-05 4.7284216E-05 2.3528598E-05 9.1736523E-06 4 5.3523591E+04 5.6993400E-04 2.9976589E-04 1.4836570E-04 5.8137666E-05 5 1.5669397E+04 3.1670644E-03 1.6749845E-03 8.3469898E-04 3.2572832E-04 6 5.2326705E+03 1.4937998E-02 7.9717842E-03 3.9605698E-03 1.5527125E-03 7 1.9565976E+03 5.7418472E-02 3.1293997E-02 1.5708145E-02 6.1395699E-03 8 8.0119731E+02 1.7068247E-01 9.6719323E-02 4.8732349E-02 1.9174535E-02 9 3.5091728E+02 3.4999401E-01 2.1091459E-01 1.0884325E-01 4.2720539E-02 10 1.6136672E+02 3.9763627E-01 2.2853192E-01 1.1366172E-01 4.5002149E-02 11 7.5381526E+01 1.6904950E-01 -1.6082541E-01 -1.3338191E-01 -5.9204972E-02 12 3.6636306E+01 8.5924226E-03 -6.1795809E-01 -5.1704575E-01 -2.2202603E-01 13 1.7921896E+01 2.8316966E-03 -3.3307288E-01 -8.2089878E-02 -1.8879917E-02 14 8.3625105E+00 -1.6439234E-03 -2.9364079E-02 7.1630932E-01 4.6150127E-01 15 3.9334461E+00 7.3985754E-04 -1.0700421E-03 4.3890403E-01 2.3131838E-01 16 1.5882407E+00 -2.9664644E-04 3.2358326E-04 3.1009265E-02 -6.4137793E-01 17 6.3724541E-01 1.0771163E-04 -8.2164093E-05 -4.5429445E-04 -5.5290792E-01 18 1.3801485E-01 -2.5913010E-05 3.0195147E-05 1.2609226E-04 -4.8002777E-02 19 4.1618396E-02 9.4789277E-06 -1.0805864E-05 -4.2908192E-05 9.5451776E-03 3d- 4d- 5d- 1 4.4038294E+03 1.6186681E-03 8.3354816E-04 2.4669790E-04 2 1.1869536E+03 1.1266205E-02 5.8439358E-03 1.7175593E-03 3 4.3209912E+02 5.4460494E-02 2.8601142E-02 8.5024727E-03 4 1.8137709E+02 1.7905042E-01 9.5992133E-02 2.8339400E-02 5 8.2508034E+01 3.6878100E-01 1.9659816E-01 5.8866072E-02 6 3.9230916E+01 4.0888716E-01 1.7145259E-01 4.6214707E-02 7 1.8825208E+01 1.7566128E-01 -2.0406000E-01 -7.7927667E-02 8 8.8841282E+00 1.7550734E-02 -5.4913526E-01 -2.0786338E-01 9 4.0759000E+00 1.2399441E-03 -3.5944578E-01 -5.0456863E-02 10 1.6023488E+00 -2.0875667E-04 -4.8916217E-02 3.9260445E-01 11 6.1433546E-01 9.4961769E-05 2.2980604E-03 5.3024213E-01 12 2.0453950E-01 -3.6854315E-05 -1.0873238E-03 2.8919782E-01 3d+ 4d+ 5d+ 1 4.4038294E+03 7.9550327E-04 4.0911791E-04 1.1799256E-04 2 1.1869536E+03 8.3158590E-03 4.3079149E-03 1.2298826E-03 3 4.3209912E+02 4.6902012E-02 2.4575238E-02 7.0987134E-03 4 1.8137709E+02 1.6618916E-01 8.9018495E-02 2.5557431E-02 5 8.2508034E+01 3.5925770E-01 1.9218988E-01 5.5908159E-02 6 3.9230916E+01 4.1849358E-01 1.8372387E-01 4.9208116E-02 7 1.8825208E+01 1.9061584E-01 -1.7585140E-01 -6.6458023E-02 8 8.8841282E+00 2.0730584E-02 -5.4307057E-01 -1.9874953E-01 9 4.0759000E+00 1.3577536E-03 -3.8354275E-01 -6.9751663E-02 10 1.6023488E+00 -1.9784135E-04 -5.7373714E-02 3.5897554E-01 11 6.1433546E-01 9.6263781E-05 2.8389448E-03 5.3144996E-01 12 2.0453950E-01 -3.8469049E-05 -1.3540196E-03 3.2977087E-01 4f- 1 3.7607630E+02 3.0331601E-03 2 1.2770223E+02 2.3807265E-02 3 5.3273822E+01 9.6220617E-02 4 2.4233222E+01 2.4105512E-01 5 1.1367661E+01 3.6952488E-01 6 5.2739356E+00 3.6338377E-01 7 2.3330345E+00 2.0467726E-01 8 9.0639763E-01 4.5435159E-02 4f+ 1 3.7607630E+02 2.6356446E-03 2 1.2770223E+02 2.2241766E-02 3 5.3273822E+01 9.2767900E-02 4 2.4233222E+01 2.3573928E-01 5 1.1367661E+01 3.6653426E-01 6 5.2739356E+00 3.6711494E-01 7 2.3330345E+00 2.1115499E-01 8 9.0639763E-01 4.9049286E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0554041E+07 3.2538635E-04 1.2555131E-04 5.9966993E-05 2.9872209E-05 1.2771804E-05 3.7544423E-06 2 1.1143707E+07 1.1640750E-03 4.4859528E-04 2.1456465E-04 1.0680283E-04 4.5663820E-05 1.3422097E-05 3 3.0420913E+06 2.6595012E-03 1.0275050E-03 4.9077040E-04 2.4450930E-04 1.0454047E-04 3.0731528E-05 4 9.1604274E+05 5.6026373E-03 2.1629712E-03 1.0352482E-03 5.1526657E-04 2.2030856E-04 6.4754631E-05 5 2.9956850E+05 1.0950438E-02 4.2496698E-03 2.0305097E-03 1.0119976E-03 4.3269847E-04 1.2720355E-04 6 1.0462814E+05 2.0355059E-02 7.9203298E-03 3.7979248E-03 1.8905424E-03 8.0839517E-04 2.3760498E-04 7 3.8723387E+04 3.5625424E-02 1.4081395E-02 6.7458127E-03 3.3656459E-03 1.4393057E-03 4.2315258E-04 8 1.5077101E+04 5.7902111E-02 2.3393213E-02 1.1302985E-02 5.6337296E-03 2.4099663E-03 7.0835085E-04 9 6.1411452E+03 8.3205432E-02 3.5780626E-02 1.7383314E-02 8.7104049E-03 3.7282808E-03 1.0963533E-03 10 2.6039146E+03 9.6125179E-02 4.5993925E-02 2.2998581E-02 1.1541997E-02 4.9468364E-03 1.4542385E-03 11 1.1453476E+03 7.1896986E-02 4.2131919E-02 2.1624550E-02 1.1032968E-02 4.7396688E-03 1.3951480E-03 12 5.2197130E+02 2.3718045E-02 4.6268716E-03 1.6382554E-03 6.0260404E-04 2.4276231E-04 6.9188615E-05 13 2.3112078E+02 1.5240259E-03 -4.5252347E-02 -3.8173402E-02 -2.1624294E-02 -9.5495763E-03 -2.8195055E-03 14 1.0825551E+02 -1.9723691E-05 -3.7157951E-02 -4.0277559E-02 -2.5513975E-02 -1.1564620E-02 -3.4357615E-03 15 4.5166553E+01 -3.3743728E-06 -4.7577003E-03 1.7236435E-02 1.7647525E-02 8.9155173E-03 2.7000435E-03 16 2.3576687E+01 1.8067201E-06 5.3168033E-04 2.6103944E-02 3.2134933E-02 1.7315754E-02 5.2792666E-03 17 9.7353224E+00 -9.6610704E-07 -1.2636689E-04 2.6880788E-03 -1.0345012E-02 -8.4412854E-03 -2.7231167E-03 18 4.9359837E+00 4.9953150E-07 4.3353742E-05 -2.3631575E-04 -1.3160348E-02 -1.3450531E-02 -4.7010979E-03 19 1.5726304E+00 -1.3371134E-07 -7.8959243E-06 3.6299949E-05 -5.8667242E-04 5.9698826E-03 2.9842902E-03 20 7.3587053E-01 5.3091229E-08 2.3957373E-06 -1.1319702E-05 8.2956451E-05 3.6130401E-03 2.2010397E-03 21 1.5177204E-01 -9.9130539E-09 -2.1037724E-07 1.0911873E-06 -7.0101796E-06 8.0392559E-05 -1.4603507E-03 22 5.4134642E-02 3.7257908E-09 3.3955459E-08 -2.3450501E-07 1.6461053E-06 -6.1298261E-06 -8.9763319E-04 2p- 3p- 4p- 5p- 1 6.6448052E+06 9.0958147E-05 4.6089206E-05 2.2791059E-05 9.1246164E-06 2 1.0175399E+06 3.0702033E-04 1.5578686E-04 7.6960008E-05 3.0859442E-05 3 2.1240039E+05 8.5779181E-04 4.3668679E-04 2.1630911E-04 8.6562959E-05 4 5.3523591E+04 2.2712869E-03 1.1607862E-03 5.7406839E-04 2.3042370E-04 5 1.5669397E+04 5.7258165E-03 2.9476655E-03 1.4646286E-03 5.8613604E-04 6 5.2326705E+03 1.3363748E-02 6.9548046E-03 3.4525178E-03 1.3878660E-03 7 1.9565976E+03 2.7528463E-02 1.4671131E-02 7.3546124E-03 2.9466088E-03 8 8.0119731E+02 4.6156842E-02 2.5606757E-02 1.2894648E-02 5.2079928E-03 9 3.5091728E+02 5.4506774E-02 3.1897457E-02 1.6424336E-02 6.5948186E-03 10 1.6136672E+02 3.4648667E-02 1.6119026E-02 7.3311941E-03 2.9602814E-03 11 7.5381526E+01 7.1315706E-03 -2.0262240E-02 -1.5507993E-02 -6.9844672E-03 12 3.6636306E+01 -3.1614279E-04 -2.9870589E-02 -2.4913596E-02 -1.0912062E-02 13 1.7921896E+01 -2.3213708E-04 -8.3249600E-03 3.4091809E-03 2.6276071E-03 14 8.3625105E+00 -1.7798578E-04 -3.2519240E-04 1.7734207E-02 1.2207338E-02 15 3.9334461E+00 -9.8137883E-05 -1.8118508E-05 5.1720724E-03 1.1495523E-03 16 1.5882407E+00 -5.4333564E-05 2.0558242E-06 1.3156235E-04 -7.6224748E-03 17 6.3724541E-01 -3.6425945E-05 -1.1172340E-06 -5.3519822E-06 -2.7179240E-03 18 1.3801485E-01 -1.6024700E-05 -2.1023976E-07 -2.6981858E-06 -6.6335713E-05 19 4.1618396E-02 -4.9411293E-06 -1.0159972E-07 -8.0487940E-07 6.2591922E-06 2p+ 3p+ 4p+ 5p+ 1 6.6448052E+06 3.0724167E-06 1.6027451E-06 8.0423437E-07 3.1108730E-07 2 1.0175399E+06 2.3607188E-05 1.2296535E-05 6.0343249E-06 2.3752123E-06 3 2.1240039E+05 1.3505107E-04 7.0458873E-05 3.5121506E-05 1.3657926E-05 4 5.3523591E+04 6.2803616E-04 3.2781607E-04 1.6172086E-04 6.3420214E-05 5 1.5669397E+04 2.4013228E-03 1.2585154E-03 6.2626516E-04 2.4414115E-04 6 5.2326705E+03 7.5434525E-03 3.9864358E-03 1.9753492E-03 7.7425215E-04 7 1.9565976E+03 1.9213148E-02 1.0371007E-02 5.1951421E-03 2.0292797E-03 8 8.0119731E+02 3.8181476E-02 2.1447019E-02 1.0783807E-02 4.2415653E-03 9 3.5091728E+02 5.3020510E-02 3.1716740E-02 1.6343027E-02 6.4122744E-03 10 1.6136672E+02 4.1338704E-02 2.3660135E-02 1.1767519E-02 4.6591227E-03 11 7.5381526E+01 1.2073184E-02 -1.1259192E-02 -9.3314494E-03 -4.1421494E-03 12 3.6636306E+01 4.2891332E-04 -3.0514608E-02 -2.5493885E-02 -1.0944761E-02 13 1.7921896E+01 9.8607059E-05 -1.1527431E-02 -2.8559997E-03 -6.6384333E-04 14 8.3625105E+00 -3.9077130E-05 -6.9372784E-04 1.6898389E-02 1.0883311E-02 15 3.9334461E+00 1.2054002E-05 -1.7589324E-05 7.1047687E-03 3.7441673E-03 16 1.5882407E+00 -3.0635728E-06 3.4295571E-06 3.1900421E-04 -6.5943495E-03 17 6.3724541E-01 7.0184851E-07 -5.6973158E-07 -2.9685872E-06 -3.6012172E-03 18 1.3801485E-01 -7.7704628E-08 9.9237072E-08 3.8403316E-07 -1.4549550E-04 19 4.1618396E-02 1.5327127E-08 -2.0739900E-08 -7.2057413E-08 1.5885463E-05 3d- 4d- 5d- 1 4.4038294E+03 6.0563932E-04 3.1214135E-04 9.2611534E-05 2 1.1869536E+03 3.1201182E-03 1.6190241E-03 4.7549507E-04 3 4.3209912E+02 1.0163426E-02 5.3380940E-03 1.5873944E-03 4 1.8137709E+02 2.2604552E-02 1.2122563E-02 3.5786324E-03 5 8.2508034E+01 3.1929252E-02 1.7035438E-02 5.1018806E-03 6 3.9230916E+01 2.4574746E-02 1.0328563E-02 2.7858769E-03 7 1.8825208E+01 7.2996494E-03 -8.5222802E-03 -3.2535291E-03 8 8.8841282E+00 4.7952625E-04 -1.5786602E-02 -5.9757256E-03 9 4.0759000E+00 1.2500639E-05 -7.0010777E-03 -9.8392320E-04 10 1.6023488E+00 -6.6750073E-06 -5.9563372E-04 4.7964453E-03 11 6.1433546E-01 -4.9494759E-07 1.7992732E-05 4.0117033E-03 12 2.0453950E-01 -6.1063670E-07 -4.4984523E-06 1.2624950E-03 3d+ 4d+ 5d+ 1 4.4038294E+03 4.3328453E-04 2.2233231E-04 6.4153489E-05 2 1.1869536E+03 2.5839570E-03 1.3358503E-03 3.8113798E-04 3 4.3209912E+02 9.1349664E-03 4.7774826E-03 1.3797202E-03 4 1.8137709E+02 2.1347324E-02 1.1416594E-02 3.2767364E-03 5 8.2508034E+01 3.1378258E-02 1.6766353E-02 4.8765494E-03 6 3.9230916E+01 2.5298681E-02 1.1104656E-02 2.9748517E-03 7 1.8825208E+01 7.9961275E-03 -7.3469264E-03 -2.7764113E-03 8 8.8841282E+00 5.9695438E-04 -1.5622457E-02 -5.7162837E-03 9 4.0759000E+00 2.6737010E-05 -7.4762648E-03 -1.3599090E-03 10 1.6023488E+00 -2.5174036E-06 -7.0134177E-04 4.3861758E-03 11 6.1433546E-01 7.6680649E-07 2.1509093E-05 4.0211316E-03 12 2.0453950E-01 -1.7903464E-07 -5.9188105E-06 1.4397448E-03 4f- 1 3.7607630E+02 5.9100202E-04 2 1.2770223E+02 2.8670967E-03 3 5.3273822E+01 7.6052027E-03 4 2.4233222E+01 1.2931775E-02 5 1.1367661E+01 1.3610484E-02 6 5.2739356E+00 9.1262237E-03 7 2.3330345E+00 3.4197794E-03 8 9.0639763E-01 4.7295233E-04 4f+ 1 3.7607630E+02 5.4116092E-04 2 1.2770223E+02 2.7179954E-03 3 5.3273822E+01 7.3748229E-03 4 2.4233222E+01 1.2680136E-02 5 1.1367661E+01 1.3518980E-02 6 5.2739356E+00 9.2270368E-03 7 2.3330345E+00 3.5304655E-03 8 9.0639763E-01 5.1117849E-04 ** Au ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0874159E+07 2.5601747E-04 9.9486415E-05 4.7646489E-05 2.3808590E-05 1.0287365E-05 3.0283619E-06 2 1.1304982E+07 7.0003199E-04 2.7316200E-04 1.3096429E-04 6.5441227E-05 2.8277775E-05 8.3241943E-06 3 3.1073467E+06 1.6722459E-03 6.5701083E-04 3.1516353E-04 1.5756510E-04 6.8088360E-05 2.0044181E-05 4 9.4045868E+05 3.7685314E-03 1.4938603E-03 7.1820641E-04 3.5906037E-04 1.5517768E-04 4.5680526E-05 5 3.0871304E+05 8.4133146E-03 3.3827590E-03 1.6281048E-03 8.1482208E-04 3.5217891E-04 1.0368192E-04 6 1.0810191E+05 1.8779877E-02 7.6670165E-03 3.7054325E-03 1.8541763E-03 8.0156748E-04 2.3596589E-04 7 4.0077299E+04 4.1786815E-02 1.7487632E-02 8.4651151E-03 4.2445288E-03 1.8351957E-03 5.4033936E-04 8 1.5619671E+04 9.0562915E-02 3.9048875E-02 1.9064097E-02 9.5566039E-03 4.1337173E-03 1.2169285E-03 9 6.3650098E+03 1.8048703E-01 8.2989905E-02 4.0774821E-02 2.0539755E-02 8.8888760E-03 2.6177912E-03 10 2.6989909E+03 2.9696401E-01 1.5156740E-01 7.6515685E-02 3.8608694E-02 1.6732491E-02 4.9267422E-03 11 1.1869469E+03 3.2187880E-01 1.9889936E-01 1.0276473E-01 5.2652438E-02 2.2860799E-02 6.7387663E-03 12 5.4083495E+02 1.5540915E-01 2.6850831E-02 7.0544698E-03 1.7783464E-03 6.4339934E-04 1.7385348E-04 13 2.3943008E+02 1.5280302E-02 -4.7156968E-01 -4.0286311E-01 -2.2970221E-01 -1.0264589E-01 -3.0362752E-02 14 1.1215195E+02 -3.4580538E-04 -5.6056922E-01 -6.1235302E-01 -3.8950444E-01 -1.7849163E-01 -5.3114576E-02 15 4.6894425E+01 -2.2669787E-05 -1.1213739E-01 4.0335124E-01 4.1672314E-01 2.1312837E-01 6.4677941E-02 16 2.4493222E+01 1.3385058E-05 1.7436462E-02 8.5087097E-01 1.0528180E+00 5.7511806E-01 1.7588829E-01 17 1.0148220E+01 -1.9037961E-05 -6.6321949E-03 1.3866062E-01 -5.1549883E-01 -4.2973874E-01 -1.3948952E-01 18 5.1705371E+00 1.6149808E-05 3.2663964E-03 -1.7307946E-02 -9.4566895E-01 -9.8002696E-01 -3.4411781E-01 19 1.6681143E+00 -6.1498281E-06 -1.0986776E-03 4.7317573E-03 -7.5647827E-02 7.6185778E-01 3.8660572E-01 20 7.8012050E-01 2.7302478E-06 5.0578488E-04 -2.1562425E-03 1.5181953E-02 6.6896981E-01 4.0080024E-01 21 1.6103441E-01 -6.6823940E-07 -1.1794512E-04 4.7217419E-04 -2.7858903E-03 3.2425291E-02 -5.9036695E-01 22 5.6807117E-02 2.6207839E-07 4.6139250E-05 -1.8018763E-04 1.0827285E-03 -4.0750346E-03 -6.1276723E-01 2p- 3p- 4p- 5p- 1 7.1559085E+06 2.7152387E-04 1.3768476E-04 6.8304234E-05 2.7719721E-05 2 1.1043723E+06 8.1201476E-04 4.1190589E-04 2.0433866E-04 8.2936236E-05 3 2.3120171E+05 2.1283244E-03 1.0806895E-03 5.3637174E-04 2.1765860E-04 4 5.8261452E+04 5.2955538E-03 2.6960029E-03 1.3381424E-03 5.4339735E-04 5 1.7012091E+04 1.3344627E-02 6.8373522E-03 3.4029221E-03 1.3807315E-03 6 5.6557886E+03 3.5068049E-02 1.8194853E-02 9.0626555E-03 3.6873954E-03 7 2.1045185E+03 9.2394863E-02 4.9100353E-02 2.4682711E-02 1.0022408E-02 8 8.5804758E+02 2.1566367E-01 1.1928496E-01 6.0237543E-02 2.4636641E-02 9 3.7454479E+02 3.7032809E-01 2.1524741E-01 1.1111416E-01 4.5206033E-02 10 1.7184040E+02 3.5265285E-01 1.6780684E-01 7.7452249E-02 3.1687684E-02 11 8.0435133E+01 1.1936608E-01 -2.6492846E-01 -2.0524940E-01 -9.3972288E-02 12 3.9019471E+01 3.9677453E-03 -6.0597022E-01 -5.0986654E-01 -2.2687839E-01 13 1.9149586E+01 1.5719872E-03 -2.5676703E-01 6.9206434E-02 6.1626518E-02 14 8.8850749E+00 -8.8629293E-04 -1.6727710E-02 7.5472973E-01 5.2875014E-01 15 4.1899082E+00 3.7152497E-04 -5.9763247E-04 3.3507347E-01 8.5526623E-02 16 1.6897469E+00 -1.4544090E-04 1.6004992E-04 1.5053469E-02 -7.4927728E-01 17 6.7766221E-01 5.3495122E-05 -2.3209117E-05 -2.4619137E-05 -4.1638216E-01 18 1.4536215E-01 -1.2432981E-05 1.2249489E-05 1.3498484E-05 -2.1025761E-02 19 4.3187289E-02 4.5214480E-06 -4.2511250E-06 -5.7685952E-06 3.7163883E-03 2p+ 3p+ 4p+ 5p+ 1 7.1559085E+06 1.3967768E-06 7.3088516E-07 3.6525554E-07 1.4425987E-07 2 1.1043723E+06 1.2075192E-05 6.3325935E-06 3.1406893E-06 1.2476237E-06 3 2.3120171E+05 8.5088915E-05 4.4727403E-05 2.2361632E-05 8.8380045E-06 4 5.8261452E+04 5.3305494E-04 2.8127578E-04 1.3980243E-04 5.5526495E-05 5 1.7012091E+04 2.9557354E-03 1.5670209E-03 7.8454796E-04 3.1034873E-04 6 5.6557886E+03 1.3994672E-02 7.4895377E-03 3.7366000E-03 1.4847942E-03 7 2.1045185E+03 5.4266567E-02 2.9616317E-02 1.4931808E-02 5.9159478E-03 8 8.5804758E+02 1.6349124E-01 9.2737671E-02 4.6902883E-02 1.8703492E-02 9 3.7454479E+02 3.4245229E-01 2.0615375E-01 1.0681001E-01 4.2499161E-02 10 1.7184040E+02 4.0217679E-01 2.3528317E-01 1.1814199E-01 4.7428068E-02 11 8.0435133E+01 1.8058047E-01 -1.3498006E-01 -1.1600178E-01 -5.2601760E-02 12 3.9019471E+01 1.1584675E-02 -6.1145097E-01 -5.1382600E-01 -2.2403413E-01 13 1.9149586E+01 2.6078416E-03 -3.5466576E-01 -1.1836997E-01 -3.7122415E-02 14 8.8850749E+00 -1.5278209E-03 -3.5383620E-02 7.0746242E-01 4.6382767E-01 15 4.1899082E+00 6.8969216E-04 -3.7799626E-04 4.5950633E-01 2.5301576E-01 16 1.6897469E+00 -2.7623878E-04 9.0031895E-05 3.4148906E-02 -6.4518495E-01 17 6.7766221E-01 1.0081233E-04 3.5022733E-06 -6.5496984E-04 -5.5660012E-01 18 1.4536215E-01 -2.3787479E-05 1.0762615E-05 1.8113193E-04 -4.7292206E-02 19 4.3187289E-02 8.6433224E-06 -3.6558193E-06 -6.1403330E-05 9.4234111E-03 3d- 4d- 5d- 1 4.6002843E+03 1.6142858E-03 8.3718949E-04 2.5561077E-04 2 1.2365352E+03 1.1165338E-02 5.8333676E-03 1.7689373E-03 3 4.4941404E+02 5.3934635E-02 2.8525111E-02 8.7490176E-03 4 1.8847622E+02 1.7773974E-01 9.5975295E-02 2.9238508E-02 5 8.5714341E+01 3.6758559E-01 1.9741997E-01 6.0994443E-02 6 4.0767399E+01 4.0960502E-01 1.7360539E-01 4.8280050E-02 7 1.9582525E+01 1.7738718E-01 -2.0282152E-01 -8.0563120E-02 8 9.2604450E+00 1.7967846E-02 -5.5014700E-01 -2.1614154E-01 9 4.2736870E+00 1.2312989E-03 -3.5835844E-01 -5.0494398E-02 10 1.7010646E+00 -2.1659726E-04 -4.8591783E-02 4.0365365E-01 11 6.5750914E-01 9.8201811E-05 2.1864580E-03 5.2864583E-01 12 2.2065000E-01 -3.6306981E-05 -9.8555757E-04 2.7703499E-01 3d+ 4d+ 5d+ 1 4.6002843E+03 7.7796763E-04 4.0303096E-04 1.1983407E-04 2 1.2365352E+03 8.1592533E-03 4.2583949E-03 1.2534136E-03 3 4.4941404E+02 4.6214007E-02 2.4391275E-02 7.2640161E-03 4 1.8847622E+02 1.6454301E-01 8.8792469E-02 2.6286335E-02 5 8.5714341E+01 3.5770513E-01 1.9285050E-01 5.7847745E-02 6 4.0767399E+01 4.1932829E-01 1.8621930E-01 5.1441288E-02 7 1.9582525E+01 1.9280980E-01 -1.7373251E-01 -6.8337104E-02 8 9.2604450E+00 2.1305532E-02 -5.4396818E-01 -2.0650622E-01 9 4.2736870E+00 1.3514815E-03 -3.8304710E-01 -7.1086353E-02 10 1.7010646E+00 -2.0532106E-04 -5.7175871E-02 3.6880370E-01 11 6.5750914E-01 9.9332765E-05 2.7023670E-03 5.3082561E-01 12 2.2065000E-01 -3.7761928E-05 -1.2343546E-03 3.1903273E-01 4f- 1 3.9997272E+02 2.9016357E-03 2 1.3579890E+02 2.2925896E-02 3 5.6746619E+01 9.3645787E-02 4 2.5870174E+01 2.3757844E-01 5 1.2185153E+01 3.6895486E-01 6 5.6879984E+00 3.6558989E-01 7 2.5375087E+00 2.0472703E-01 8 9.9485802E-01 4.4577170E-02 4f+ 1 3.9997272E+02 2.5051684E-03 2 1.3579890E+02 2.1356735E-02 3 5.6746619E+01 9.0163908E-02 4 2.5870174E+01 2.3221852E-01 5 1.2185153E+01 3.6585738E-01 6 5.6879984E+00 3.6940046E-01 7 2.5375087E+00 2.1123095E-01 8 9.9485802E-01 4.8063814E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0874159E+07 3.3793964E-04 1.3100311E-04 6.2677110E-05 3.1324777E-05 1.3534396E-05 3.9843336E-06 2 1.1304982E+07 1.2062609E-03 4.6702853E-04 2.2375153E-04 1.1174399E-04 4.8283012E-05 1.4212566E-05 3 3.1073467E+06 2.7410963E-03 1.0639840E-03 5.0906021E-04 2.5445418E-04 1.0994181E-04 3.2365735E-05 4 9.4045868E+05 5.7491805E-03 2.2299944E-03 1.0690936E-03 5.3387468E-04 2.3068692E-04 6.7903773E-05 5 3.0871304E+05 1.1189980E-02 4.3629766E-03 2.0882309E-03 1.0441790E-03 4.5117160E-04 1.3282416E-04 6 1.0810191E+05 2.0728000E-02 8.1031444E-03 3.8919791E-03 1.9437931E-03 8.3999468E-04 2.4725321E-04 7 4.0077299E+04 3.6169786E-02 1.4360980E-02 6.8915851E-03 3.4496252E-03 1.4907771E-03 4.3891066E-04 8 1.5619671E+04 5.8653230E-02 2.3795128E-02 1.1515294E-02 5.7586305E-03 2.4896138E-03 7.3283637E-04 9 6.3650098E+03 8.4177415E-02 3.6312318E-02 1.7669897E-02 8.8826563E-03 3.8420184E-03 1.1314041E-03 10 2.6989909E+03 9.7309411E-02 4.6605293E-02 2.3330746E-02 1.1747173E-02 5.0886193E-03 1.4981582E-03 11 1.1869469E+03 7.3087814E-02 4.2661398E-02 2.1911703E-02 1.1212599E-02 4.8668259E-03 1.4345506E-03 12 5.4083495E+02 2.4374393E-02 4.7413879E-03 1.6425398E-03 5.9923810E-04 2.4439893E-04 6.9855095E-05 13 2.3943008E+02 1.6077773E-03 -4.5832306E-02 -3.8714477E-02 -2.2017706E-02 -9.8333697E-03 -2.9083985E-03 14 1.1215195E+02 -2.4002863E-05 -3.7850611E-02 -4.1030709E-02 -2.6073021E-02 -1.1945271E-02 -3.5544914E-03 15 4.6894425E+01 -2.0239275E-06 -4.9003716E-03 1.7338770E-02 1.7869404E-02 9.1333933E-03 2.7715286E-03 16 2.4493222E+01 1.2413573E-06 5.4423190E-04 2.6682532E-02 3.2951173E-02 1.7995863E-02 5.5034236E-03 17 1.0148220E+01 -8.1821838E-07 -1.3099074E-04 2.7946660E-03 -1.0367834E-02 -8.6360530E-03 -2.8027038E-03 18 5.1705371E+00 4.5786182E-07 4.5301260E-05 -2.4703021E-04 -1.3596433E-02 -1.4084978E-02 -4.9455767E-03 19 1.6681143E+00 -1.2892286E-07 -8.2778414E-06 3.7885331E-05 -6.1821111E-04 6.2177683E-03 3.1549041E-03 20 7.8012050E-01 5.1990709E-08 2.4759193E-06 -1.1669126E-05 8.4961576E-05 3.7346728E-03 2.2373793E-03 21 1.6103441E-01 -1.0070028E-08 -2.1331815E-07 1.1076384E-06 -7.1066403E-06 8.2192963E-05 -1.4972026E-03 22 5.6807117E-02 3.8378538E-09 3.3171776E-08 -2.3348874E-07 1.6470581E-06 -6.1202888E-06 -9.2297901E-04 2p- 3p- 4p- 5p- 1 7.1559085E+06 9.2974499E-05 4.7198935E-05 2.3433911E-05 9.5057362E-06 2 1.1043723E+06 3.1205694E-04 1.5866747E-04 7.8689380E-05 3.1967765E-05 3 2.3120171E+05 8.6454483E-04 4.4087712E-04 2.1927549E-04 8.8909050E-05 4 5.8261452E+04 2.2694419E-03 1.1622599E-03 5.7700187E-04 2.3464586E-04 5 1.7012091E+04 5.6873725E-03 2.9323761E-03 1.4630487E-03 5.9323805E-04 6 5.6557886E+03 1.3244923E-02 6.9055765E-03 3.4408015E-03 1.4013362E-03 7 2.1045185E+03 2.7346645E-02 1.4580586E-02 7.3384170E-03 2.9788994E-03 8 8.5804758E+02 4.6215202E-02 2.5645007E-02 1.2955359E-02 5.3008741E-03 9 3.7454479E+02 5.5485628E-02 3.2424252E-02 1.6760905E-02 6.8195310E-03 10 1.7184040E+02 3.6341286E-02 1.7533411E-02 8.1301796E-03 3.3313435E-03 11 8.0435133E+01 7.9253539E-03 -1.9365252E-02 -1.4917867E-02 -6.8243855E-03 12 3.9019471E+01 -2.7787081E-04 -3.0918840E-02 -2.5968617E-02 -1.1553655E-02 13 1.9149586E+01 -2.5311801E-04 -9.1955697E-03 2.4129442E-03 2.1678881E-03 14 8.8850749E+00 -1.9026976E-04 -4.1029955E-04 1.8328977E-02 1.2842988E-02 15 4.1899082E+00 -1.0460285E-04 -1.1881915E-05 5.5805897E-03 1.4255411E-03 16 1.6897469E+00 -5.8347073E-05 8.3291621E-07 1.5025461E-04 -7.9479603E-03 17 6.7766221E-01 -3.8964589E-05 -7.9753246E-07 -6.6679746E-06 -2.7977179E-03 18 1.4536215E-01 -1.7211991E-05 -2.3337527E-07 -2.8106915E-06 -6.5835864E-05 19 4.3187289E-02 -5.1958714E-06 -9.1381518E-08 -8.7119990E-07 6.1695365E-06 2p+ 3p+ 4p+ 5p+ 1 7.1559085E+06 2.9581563E-06 1.5449194E-06 7.7978068E-07 3.0573474E-07 2 1.1043723E+06 2.2531095E-05 1.1784381E-05 5.8031189E-06 2.3153598E-06 3 2.3120171E+05 1.2854854E-04 6.7203495E-05 3.3670398E-05 1.3272172E-05 4 5.8261452E+04 5.9807096E-04 3.1323914E-04 1.5514903E-04 6.1671304E-05 5 1.7012091E+04 2.2990482E-03 1.2075813E-03 6.0376475E-04 2.3858410E-04 6 5.6557886E+03 7.2807308E-03 3.8578648E-03 1.9194561E-03 7.6255025E-04 7 2.1045185E+03 1.8740145E-02 1.0126497E-02 5.0948580E-03 2.0172702E-03 8 8.5804758E+02 3.7756593E-02 2.1223817E-02 1.0710976E-02 4.2696301E-03 9 3.7454479E+02 5.3539946E-02 3.1984799E-02 1.6545637E-02 6.5809197E-03 10 1.7184040E+02 4.3133276E-02 2.5118979E-02 1.2610602E-02 5.0623568E-03 11 8.0435133E+01 1.3323538E-02 -9.7350635E-03 -8.3654646E-03 -3.7940674E-03 12 3.9019471E+01 5.9662484E-04 -3.1153923E-02 -2.6139407E-02 -1.1394065E-02 13 1.9149586E+01 9.4010164E-05 -1.2688674E-02 -4.2481270E-03 -1.3378702E-03 14 8.8850749E+00 -3.7510600E-05 -8.6173551E-04 1.7202399E-02 1.1274005E-02 15 4.1899082E+00 1.1634203E-05 -6.6316082E-06 7.6770699E-03 4.2267552E-03 16 1.6897469E+00 -2.9565877E-06 1.0791175E-06 3.6235536E-04 -6.8421633E-03 17 6.7766221E-01 6.8223721E-07 -1.9459147E-08 -4.4076445E-06 -3.7384762E-03 18 1.4536215E-01 -7.4263082E-08 4.3117440E-08 5.6486037E-07 -1.4710778E-04 19 4.3187289E-02 1.4609357E-08 -9.6372735E-09 -1.0457493E-07 1.5975588E-05 3d- 4d- 5d- 1 4.6002843E+03 6.0833110E-04 3.1575772E-04 9.6651219E-05 2 1.2365352E+03 3.1359313E-03 1.6390190E-03 4.9665759E-04 3 4.4941404E+02 1.0237495E-02 5.4150173E-03 1.6613965E-03 4 1.8847622E+02 2.2848058E-02 1.2341484E-02 3.7595017E-03 5 8.5714341E+01 3.2422597E-02 1.7427855E-02 5.3856562E-03 6 4.0767399E+01 2.5089853E-02 1.0659495E-02 2.9664821E-03 7 1.9582525E+01 7.5167786E-03 -8.6380190E-03 -3.4300054E-03 8 9.2604450E+00 5.0091364E-04 -1.6146586E-02 -6.3437106E-03 9 4.2736870E+00 1.2246636E-05 -7.1470904E-03 -1.0083649E-03 10 1.7010646E+00 -7.1480756E-06 -6.0952172E-04 5.0809951E-03 11 6.5750914E-01 -5.5564192E-07 1.7781092E-05 4.1377557E-03 12 2.2065000E-01 -6.5958098E-07 -4.1939505E-06 1.2561090E-03 3d+ 4d+ 5d+ 1 4.6002843E+03 4.3070045E-04 2.2260768E-04 6.6221328E-05 2 1.2365352E+03 2.5812311E-03 1.3443327E-03 3.9543024E-04 3 4.4941404E+02 9.1689470E-03 4.8298841E-03 1.4380783E-03 4 1.8847622E+02 2.1534724E-02 1.1601832E-02 3.4335293E-03 5 8.5714341E+01 3.1838154E-02 1.7143881E-02 5.1416148E-03 6 4.0767399E+01 2.5840067E-02 1.1473244E-02 3.1700356E-03 7 1.9582525E+01 8.2496182E-03 -7.4018614E-03 -2.9113578E-03 8 9.2604450E+00 6.2640184E-04 -1.5976038E-02 -6.0637128E-03 9 4.2736870E+00 2.7268308E-05 -7.6457165E-03 -1.4192190E-03 10 1.7010646E+00 -2.6942603E-06 -7.2014555E-04 4.6429783E-03 11 6.5750914E-01 8.1955885E-07 2.1183294E-05 4.1551445E-03 12 2.2065000E-01 -1.8334109E-07 -5.6049414E-06 1.4466785E-03 4f- 1 3.9997272E+02 5.8014669E-04 2 1.3579890E+02 2.8422123E-03 3 5.6746619E+01 7.6335947E-03 4 2.5870174E+01 1.3164623E-02 5 1.2185153E+01 1.4067641E-02 6 5.6879984E+00 9.5346360E-03 7 2.5375087E+00 3.5671706E-03 8 9.9485802E-01 4.8606588E-04 4f+ 1 3.9997272E+02 5.2946632E-04 2 1.3579890E+02 2.6892061E-03 3 5.6746619E+01 7.3951466E-03 4 2.5870174E+01 1.2903848E-02 5 1.2185153E+01 1.3970083E-02 6 5.6879984E+00 9.6419379E-03 7 2.5375087E+00 3.6832841E-03 8 9.9485802E-01 5.2478486E-04 ** Hg ** Large component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0789551E+07 2.7076840E-04 1.0571761E-04 5.0714680E-05 2.5425322E-05 1.1131318E-05 3.2321782E-06 2 1.1386854E+07 7.3499747E-04 2.8818329E-04 1.3839527E-04 6.9383013E-05 3.0377834E-05 8.8205218E-06 3 3.1540805E+06 1.7425758E-03 6.8795102E-04 3.3056067E-04 1.6580870E-04 7.2599078E-05 2.1081151E-05 4 9.6020321E+05 3.8961865E-03 1.5520750E-03 7.4744865E-04 3.7491967E-04 1.6417660E-04 4.7670687E-05 5 3.1659993E+05 8.6294427E-03 3.4871046E-03 1.6812436E-03 8.4420331E-04 3.6971006E-04 1.0736288E-04 6 1.1121757E+05 1.9107029E-02 7.8416477E-03 3.7964025E-03 1.9060516E-03 8.3490637E-04 2.4242667E-04 7 4.1324214E+04 4.2189068E-02 1.7751600E-02 8.6086875E-03 4.3308877E-03 1.8973537E-03 5.5105689E-04 8 1.6128830E+04 9.0824141E-02 3.9376430E-02 1.9258113E-02 9.6864561E-03 4.2454141E-03 1.2327306E-03 9 6.5780018E+03 1.8010295E-01 8.3213019E-02 4.0959093E-02 2.0701130E-02 9.0775732E-03 2.6372010E-03 10 2.7903753E+03 2.9559216E-01 1.5131983E-01 7.6499202E-02 3.8729465E-02 1.7007331E-02 4.9389548E-03 11 1.2272171E+03 3.2083182E-01 1.9782529E-01 1.0229217E-01 5.2570533E-02 2.3127769E-02 6.7265980E-03 12 5.5916653E+02 1.5605482E-01 2.6116063E-02 6.2707474E-03 1.3332851E-03 4.4671421E-04 1.0899179E-04 13 2.4769175E+02 1.5650647E-02 -4.6992169E-01 -4.0228688E-01 -2.3030999E-01 -1.0432972E-01 -3.0438972E-02 14 1.1605973E+02 -3.7368763E-04 -5.6019277E-01 -6.1214136E-01 -3.9068970E-01 -1.8152221E-01 -5.3334866E-02 15 4.8644847E+01 -5.7529174E-06 -1.1299868E-01 3.9952699E-01 4.1554906E-01 2.1581790E-01 6.4770408E-02 16 2.5421103E+01 3.5512841E-06 1.7449591E-02 8.5245296E-01 1.0583488E+00 5.8721417E-01 1.7738327E-01 17 1.0568426E+01 -1.4575459E-05 -6.7098788E-03 1.4083130E-01 -5.0758420E-01 -4.3236230E-01 -1.3882706E-01 18 5.4104250E+00 1.4012453E-05 3.3234065E-03 -1.7634124E-02 -9.5327943E-01 -1.0063343E+00 -3.5156161E-01 19 1.7666705E+00 -5.3998507E-06 -1.1145058E-03 4.7818210E-03 -7.7202389E-02 7.7970902E-01 3.9781041E-01 20 8.2534914E-01 2.3445323E-06 5.0654552E-04 -2.1496316E-03 1.5093894E-02 6.6957075E-01 3.9552308E-01 21 1.7032026E-01 -5.7297467E-07 -1.1680961E-04 4.6225826E-04 -2.7631978E-03 2.6767770E-02 -6.1171891E-01 22 5.9454674E-02 2.2136476E-07 4.5087209E-05 -1.7809685E-04 1.0211798E-03 -6.0503497E-03 -5.9494643E-01 2p- 3p- 4p- 5p- 1 7.6576952E+06 2.7579619E-04 1.4011925E-04 6.9784114E-05 2.8734378E-05 2 1.1923227E+06 8.2225569E-04 4.1790265E-04 2.0812358E-04 8.5707099E-05 3 2.5052910E+05 2.1426934E-03 1.0900055E-03 5.4311178E-04 2.2361824E-04 4 6.3171585E+04 5.2920319E-03 2.6991469E-03 1.3448846E-03 5.5410276E-04 5 1.8408884E+04 1.3206568E-02 6.7766362E-03 3.3857867E-03 1.3939202E-03 6 6.0959227E+03 3.4340274E-02 1.7843098E-02 8.9203703E-03 3.6822399E-03 7 2.2579791E+03 8.9920390E-02 4.7803844E-02 2.4122073E-02 9.9385858E-03 8 9.1681696E+02 2.1037094E-01 1.1637609E-01 5.8958959E-02 2.4461875E-02 9 3.9889673E+02 3.6595005E-01 2.1240671E-01 1.1005367E-01 4.5439381E-02 10 1.8261356E+02 3.5777054E-01 1.7528120E-01 8.2198679E-02 3.4147075E-02 11 8.5619496E+01 1.2699699E-01 -2.4535515E-01 -1.9165725E-01 -8.9245692E-02 12 4.1439121E+01 5.3576538E-03 -6.0674962E-01 -5.1363473E-01 -2.3252906E-01 13 2.0379329E+01 1.4658313E-03 -2.7202278E-01 4.1826066E-02 4.8271988E-02 14 9.4053012E+00 -8.3882559E-04 -1.9676325E-02 7.5591455E-01 5.3973143E-01 15 4.4460221E+00 3.5214136E-04 -2.0483635E-04 3.4747998E-01 9.8437636E-02 16 1.7924529E+00 -1.3744655E-04 3.9173829E-05 1.6353923E-02 -7.6194662E-01 17 7.1850221E-01 5.0836929E-05 2.0176953E-05 -1.8428364E-04 -4.1132731E-01 18 1.5261483E-01 -1.1611600E-05 1.8411616E-06 3.5511116E-05 -1.8629681E-02 19 4.4700120E-02 4.1915082E-06 -5.7054077E-07 -1.5543670E-05 3.1053995E-03 2p+ 3p+ 4p+ 5p+ 1 7.6576952E+06 1.3651544E-06 7.1601940E-07 3.5951361E-07 1.4422539E-07 2 1.1923227E+06 1.1604611E-05 6.1057154E-06 3.0406634E-06 1.2264512E-06 3 2.5052910E+05 8.0779092E-05 4.2564116E-05 2.1378429E-05 8.5823178E-06 4 6.3171585E+04 5.0130449E-04 2.6536650E-04 1.3244841E-04 5.3415612E-05 5 1.8408884E+04 2.7712554E-03 1.4728037E-03 7.4075017E-04 2.9762656E-04 6 6.0959227E+03 1.3159134E-02 7.0623694E-03 3.5381938E-03 1.4276102E-03 7 2.2579791E+03 5.1429589E-02 2.8109338E-02 1.4233599E-02 5.7278331E-03 8 9.1681696E+02 1.5686208E-01 8.9077381E-02 4.5222751E-02 1.8309428E-02 9 3.9889673E+02 3.3507898E-01 2.0154193E-01 1.0482571E-01 4.2369709E-02 10 1.8261356E+02 4.0575995E-01 2.4083549E-01 1.2195426E-01 4.9710586E-02 11 8.5619496E+01 1.9169325E-01 -1.1119945E-01 -1.0012748E-01 -4.6506193E-02 12 4.1439121E+01 1.4796697E-02 -6.0401467E-01 -5.0963780E-01 -2.2616424E-01 13 2.0379329E+01 2.3446215E-03 -3.7479189E-01 -1.5088976E-01 -5.3703496E-02 14 9.4053012E+00 -1.3922923E-03 -4.1259644E-02 6.9831181E-01 4.6659503E-01 15 4.4460221E+00 6.3029735E-04 3.0427117E-04 4.7779697E-01 2.7460518E-01 16 1.7924529E+00 -2.5249114E-04 -1.3504435E-04 3.7111649E-02 -6.5479941E-01 17 7.1850221E-01 9.2623760E-05 8.3821926E-05 -8.9845492E-04 -5.5650784E-01 18 1.5261483E-01 -2.1478383E-05 -8.2152725E-06 2.1264294E-04 -4.3771234E-02 19 4.4700120E-02 7.7485107E-06 3.0533742E-06 -7.5661430E-05 8.4810624E-03 3d- 4d- 5d- 1 4.7992655E+03 1.6126874E-03 8.4223880E-04 2.6746967E-04 2 1.2865706E+03 1.1084643E-02 5.8325231E-03 1.8400016E-03 3 4.6683344E+02 5.3494132E-02 2.8490484E-02 9.0900837E-03 4 1.9560113E+02 1.7664344E-01 9.6062932E-02 3.0449763E-02 5 8.8925495E+01 3.6661699E-01 1.9833917E-01 6.3749930E-02 6 4.2304153E+01 4.1020341E-01 1.7554322E-01 5.0762051E-02 7 2.0338078E+01 1.7879200E-01 -2.0229321E-01 -8.4328188E-02 8 9.6359751E+00 1.8285458E-02 -5.5135910E-01 -2.2674461E-01 9 4.4719227E+00 1.2234055E-03 -3.5679322E-01 -5.0284364E-02 10 1.8012011E+00 -2.2073365E-04 -4.7969869E-02 4.2112307E-01 11 7.0112189E-01 1.0835339E-04 2.3613363E-03 5.3355558E-01 12 2.3690203E-01 -3.2719283E-05 -7.6925184E-04 2.4804087E-01 3d+ 4d+ 5d+ 1 4.7992655E+03 7.6230814E-04 3.9779044E-04 1.2324887E-04 2 1.2865706E+03 8.0196814E-03 4.2165981E-03 1.2932824E-03 3 4.6683344E+02 4.5604420E-02 2.4243948E-02 7.5241931E-03 4 1.9560113E+02 1.6310297E-01 8.8665403E-02 2.7356734E-02 5 8.8925495E+01 3.5638571E-01 1.9361422E-01 6.0532445E-02 6 4.2304153E+01 4.2006535E-01 1.8853604E-01 5.4262125E-02 7 2.0338078E+01 1.9467983E-01 -1.7230473E-01 -7.1330631E-02 8 9.6359751E+00 2.1772006E-02 -5.4512808E-01 -2.1712501E-01 9 4.4719227E+00 1.3456456E-03 -3.8208432E-01 -7.2542944E-02 10 1.8012011E+00 -2.0971198E-04 -5.6669553E-02 3.8550018E-01 11 7.0112189E-01 1.0959079E-04 2.8708226E-03 5.3947266E-01 12 2.3690203E-01 -3.3423504E-05 -9.7082590E-04 2.8854095E-01 4f- 1 4.2418162E+02 2.7880802E-03 2 1.4399163E+02 2.2153618E-02 3 6.0256702E+01 9.1379082E-02 4 2.7524802E+01 2.3447639E-01 5 1.3011744E+01 3.6848088E-01 6 6.1072967E+00 3.6758059E-01 7 2.7450167E+00 2.0485560E-01 8 1.0847115E+00 4.3303307E-02 4f+ 1 4.2418162E+02 2.3914867E-03 2 1.4399163E+02 2.0576781E-02 3 6.0256702E+01 8.7857640E-02 4 2.7524802E+01 2.2905593E-01 5 1.3011744E+01 3.6527634E-01 6 6.1072967E+00 3.7145991E-01 7 2.7450167E+00 2.1143793E-01 8 1.0847115E+00 4.6686252E-02 Small component functions ------------------------- 1s+ 2s+ 3s+ 4s+ 5s+ 6s+ 1 5.0789551E+07 3.5232931E-04 1.3722362E-04 6.5762451E-05 3.2974913E-05 1.4435917E-05 4.1919269E-06 2 1.1386854E+07 1.2545809E-03 4.8803388E-04 2.3419616E-04 1.1734681E-04 5.1374782E-05 1.4916310E-05 3 3.1540805E+06 2.8341446E-03 1.1052944E-03 5.2970841E-04 2.6564636E-04 1.1629668E-04 3.3771084E-05 4 9.6020321E+05 5.9158748E-03 2.3055828E-03 1.1071338E-03 5.5470110E-04 2.4285733E-04 7.0510068E-05 5 3.1659993E+05 1.1461518E-02 4.4900130E-03 2.1526548E-03 1.0799333E-03 4.7279692E-04 1.3729986E-04 6 1.1121757E+05 2.1148682E-02 8.3069048E-03 3.9963326E-03 2.0025315E-03 8.7682850E-04 2.5456785E-04 7 4.1324214E+04 3.6778220E-02 1.4669663E-02 7.0516255E-03 3.5413324E-03 1.5506717E-03 4.5035138E-04 8 1.6128830E+04 5.9475905E-02 2.4233187E-02 1.1745754E-02 5.8933893E-03 2.5815919E-03 7.4951050E-04 9 6.5780018E+03 8.5197681E-02 3.6876892E-02 1.7973291E-02 9.0646487E-03 3.9726769E-03 1.1540591E-03 10 2.7903753E+03 9.8461275E-02 4.7223584E-02 2.3668577E-02 1.1956413E-02 5.2478126E-03 1.5238059E-03 11 1.2272171E+03 7.4155239E-02 4.3127272E-02 2.2166057E-02 1.1377114E-02 5.0036402E-03 1.4552180E-03 12 5.5916653E+02 2.4933277E-02 4.7341137E-03 1.5729189E-03 5.5539091E-04 2.2686457E-04 6.3001704E-05 13 2.4769175E+02 1.6786838E-03 -4.6442872E-02 -3.9297975E-02 -2.2438967E-02 -1.0158775E-02 -2.9635269E-03 14 1.1605973E+02 -2.6465163E-05 -3.8488479E-02 -4.1725541E-02 -2.6603557E-02 -1.2357557E-02 -3.6307617E-03 15 4.8644847E+01 -1.3190129E-06 -5.0311976E-03 1.7486251E-02 1.8141445E-02 9.4157600E-03 2.8256503E-03 16 2.5421103E+01 9.7644812E-07 5.5490262E-04 2.7235993E-02 3.3746251E-02 1.8719121E-02 5.6543175E-03 17 1.0568426E+01 -7.6636276E-07 -1.3520804E-04 2.8967724E-03 -1.0416963E-02 -8.8657298E-03 -2.8461427E-03 18 5.4104250E+00 4.5144115E-07 4.7123491E-05 -2.5742199E-04 -1.4020511E-02 -1.4794886E-02 -5.1684652E-03 19 1.7666705E+00 -1.3136681E-07 -8.6326710E-06 3.9382871E-05 -6.4931985E-04 6.5487077E-03 3.3408261E-03 20 8.2534914E-01 5.3260047E-08 2.5448672E-06 -1.1955633E-05 8.6893835E-05 3.8449044E-03 2.2710384E-03 21 1.7032026E-01 -1.0492110E-08 -2.1577503E-07 1.1120309E-06 -7.2508108E-06 6.9771137E-05 -1.5954547E-03 22 5.9454674E-02 4.0133108E-09 3.2143270E-08 -2.3524157E-07 1.5906150E-06 -9.3040992E-06 -9.1678111E-04 2p- 3p- 4p- 5p- 1 7.6576952E+06 9.5324216E-05 4.8480281E-05 2.4165108E-05 9.9458936E-06 2 1.1923227E+06 3.1821462E-04 1.6212118E-04 8.0711744E-05 3.3267325E-05 3 2.5052910E+05 8.7427729E-04 4.4659128E-04 2.2300207E-04 9.1747209E-05 4 6.3171585E+04 2.2750339E-03 1.1674836E-03 5.8179157E-04 2.4003851E-04 5 1.8408884E+04 5.6655928E-03 2.9256113E-03 1.4655531E-03 6.0298465E-04 6 6.0959227E+03 1.3158003E-02 6.8726877E-03 3.4370237E-03 1.4201622E-03 7 2.2579791E+03 2.7209565E-02 1.4515204E-02 7.3340255E-03 3.0208527E-03 8 9.1681696E+02 4.6297915E-02 2.5698918E-02 1.3024507E-02 5.4061858E-03 9 3.9889673E+02 5.6415678E-02 3.2923024E-02 1.7082416E-02 7.0535562E-03 10 1.8261356E+02 3.7969516E-02 1.8861292E-02 8.8841511E-03 3.6960607E-03 11 8.5619496E+01 8.7286559E-03 -1.8502671E-02 -1.4362977E-02 -6.6820778E-03 12 4.1439121E+01 -2.3224672E-04 -3.1901472E-02 -2.6953277E-02 -1.2199803E-02 13 2.0379329E+01 -2.7585021E-04 -1.0049917E-02 1.4788290E-03 1.7429224E-03 14 9.4053012E+00 -2.0251413E-04 -4.9591614E-04 1.8885931E-02 1.3486870E-02 15 4.4460221E+00 -1.1120036E-04 -5.3547575E-06 5.9616610E-03 1.6905495E-03 16 1.7924529E+00 -6.2400572E-05 -3.8729172E-07 1.6852737E-04 -8.3244063E-03 17 7.1850221E-01 -4.1610720E-05 -4.7877432E-07 -8.2591755E-06 -2.8458719E-03 18 1.5261483E-01 -1.8429032E-05 -2.5313989E-07 -2.9583988E-06 -5.9837928E-05 19 4.4700120E-02 -5.4515984E-06 -8.0495175E-08 -9.3615427E-07 5.2198144E-06 2p+ 3p+ 4p+ 5p+ 1 7.6576952E+06 2.8668355E-06 1.4989249E-06 7.6086651E-07 3.0311020E-07 2 1.1923227E+06 2.1622595E-05 1.1355349E-05 5.6114656E-06 2.2728866E-06 3 2.5052910E+05 1.2293172E-04 6.4397400E-05 3.2425438E-05 1.2983454E-05 4 6.3171585E+04 5.7170877E-04 3.0044280E-04 1.4940443E-04 6.0299932E-05 5 1.8408884E+04 2.2075912E-03 1.1621205E-03 5.8372700E-04 2.3428921E-04 6 6.0959227E+03 7.0423557E-03 3.7415499E-03 1.8691572E-03 7.5398599E-04 7 2.2579791E+03 1.8304938E-02 9.9030364E-03 5.0038298E-03 2.0122868E-03 8 9.1681696E+02 3.7353099E-02 2.1014758E-02 1.0644793E-02 4.3080679E-03 9 3.9889673E+02 5.4005274E-02 3.2225860E-02 1.6733858E-02 6.7609776E-03 10 1.8261356E+02 4.4846762E-02 2.6486672E-02 1.3407696E-02 5.4648609E-03 11 8.5619496E+01 1.4593713E-02 -8.2448139E-03 -7.4307159E-03 -3.4526881E-03 12 4.1439121E+01 7.8527792E-04 -3.1708592E-02 -2.6711028E-02 -1.1850255E-02 13 2.0379329E+01 8.7341676E-05 -1.3833029E-02 -5.5806989E-03 -1.9912351E-03 14 9.4053012E+00 -3.5249965E-05 -1.0339287E-03 1.7469037E-02 1.1667769E-02 15 4.4460221E+00 1.0992436E-05 4.8726760E-06 8.2231659E-03 4.7255408E-03 16 1.7924529E+00 -2.7985181E-06 -1.3289144E-06 4.0558590E-04 -7.1520239E-03 17 7.1850221E-01 6.5062507E-07 5.2826163E-07 -6.2209681E-06 -3.8488613E-03 18 1.5261483E-01 -6.9836835E-08 -1.4662447E-08 6.7870662E-07 -1.3951042E-04 19 4.4700120E-02 1.3720280E-08 1.1678704E-09 -1.3079160E-07 1.4627351E-05 3d- 4d- 5d- 1 4.7992655E+03 6.1184534E-04 3.1981920E-04 1.0182509E-04 2 1.2865706E+03 3.1554361E-03 1.6610396E-03 5.2362174E-04 3 4.6683344E+02 1.0321131E-02 5.4975600E-03 1.7546221E-03 4 1.9560113E+02 2.3106117E-02 1.2569957E-02 3.9840887E-03 5 8.8925495E+01 3.2921464E-02 1.7825793E-02 5.7308615E-03 6 4.2304153E+01 2.5590082E-02 1.0978166E-02 3.1768948E-03 7 2.0338078E+01 7.7195428E-03 -8.7789094E-03 -3.6583391E-03 8 9.6359751E+00 5.1955312E-04 -1.6506413E-02 -6.7882575E-03 9 4.4719227E+00 1.1979853E-05 -7.2788729E-03 -1.0273337E-03 10 1.8012011E+00 -7.5857830E-06 -6.1904405E-04 5.4546071E-03 11 7.0112189E-01 -5.6470018E-07 1.9818047E-05 4.3124382E-03 12 2.3690203E-01 -6.9534770E-07 -3.3117701E-06 1.1653016E-03 3d+ 4d+ 5d+ 1 4.7992655E+03 4.2868458E-04 2.2315897E-04 6.9177371E-05 2 1.2865706E+03 2.5813949E-03 1.3543018E-03 4.1509407E-04 3 4.6683344E+02 9.2110098E-03 4.8868621E-03 1.5162931E-03 4 1.9560113E+02 2.1735066E-02 1.1795558E-02 3.6381480E-03 5 8.8925495E+01 3.2303604E-02 1.7527251E-02 5.4787876E-03 6 4.2304153E+01 2.6368184E-02 1.1832385E-02 3.4061846E-03 7 2.0338078E+01 8.4891939E-03 -7.4802249E-03 -3.0965288E-03 8 9.6359751E+00 6.5300010E-04 -1.6331286E-02 -6.5033410E-03 9 4.4719227E+00 2.7790104E-05 -7.8014777E-03 -1.4815868E-03 10 1.8012011E+00 -2.8357331E-06 -7.3449278E-04 4.9939563E-03 11 7.0112189E-01 9.3144893E-07 2.3236286E-05 4.3606407E-03 12 2.3690203E-01 -1.7017396E-07 -4.5694584E-06 1.3557434E-03 4f- 1 4.2418162E+02 5.7118824E-04 2 1.4399163E+02 2.8231735E-03 3 6.0256702E+01 7.6701183E-03 4 2.7524802E+01 1.3397597E-02 5 1.3011744E+01 1.4516196E-02 6 6.1072967E+00 9.9329652E-03 7 2.7450167E+00 3.7122935E-03 8 1.0847115E+00 4.9295415E-04 4f+ 1 4.2418162E+02 5.1953060E-04 2 1.4399163E+02 2.6659046E-03 3 6.0256702E+01 7.4228684E-03 4 2.7524802E+01 1.3126885E-02 5 1.3011744E+01 1.4412469E-02 6 6.1072967E+00 1.0046574E-02 7 2.7450167E+00 3.8347161E-03 8 1.0847115E+00 5.3226952E-04 Spin-free Dirac-Hartree-Fock basis sets ======================================= ** Hf ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.8655750E+07 1.7792859E-04 6.6973747E-05 3.1668292E-05 1.5460256E-05 6.0903612E-06 1.6670303E-06 2 1.0162738E+07 5.1158202E-04 1.9331162E-04 9.1507430E-05 4.4669313E-05 1.7596812E-05 4.8166355E-06 3 2.6555530E+06 1.2874499E-03 4.8974494E-04 2.3190789E-04 1.1327258E-04 4.4626912E-05 1.2215156E-05 4 7.7479033E+05 3.0664371E-03 1.1762160E-03 5.5827015E-04 2.7262910E-04 1.0740906E-04 2.9401047E-05 5 2.4763412E+05 7.2422111E-03 2.8154719E-03 1.3371065E-03 6.5376296E-04 2.5762364E-04 7.0516563E-05 6 8.5154884E+04 1.7105471E-02 6.7415196E-03 3.2154697E-03 1.5713261E-03 6.1917146E-04 1.6949469E-04 7 3.1200957E+04 4.0097573E-02 1.6182305E-02 7.7238774E-03 3.7834038E-03 1.4914672E-03 4.0824774E-04 8 1.2078618E+04 9.0718612E-02 3.7727907E-02 1.8175652E-02 8.8954994E-03 3.5065551E-03 9.6000045E-04 9 4.9069917E+03 1.8608228E-01 8.2964751E-02 4.0201973E-02 1.9787263E-02 7.8084542E-03 2.1374820E-03 10 2.0797575E+03 3.0853976E-01 1.5495096E-01 7.7417516E-02 3.8142128E-02 1.5059358E-02 4.1242622E-03 11 9.1548773E+02 3.2620527E-01 2.0510570E-01 1.0516542E-01 5.2766120E-02 2.0909014E-02 5.7249121E-03 12 4.1721154E+02 1.4532856E-01 2.3192810E-02 7.1700565E-03 1.8865091E-03 6.0486341E-04 1.6738743E-04 13 1.8530823E+02 1.1549970E-02 -4.8906547E-01 -4.1306742E-01 -2.2879188E-01 -9.2764618E-02 -2.5507791E-02 14 8.6777652E+01 1.0721496E-04 -5.5543919E-01 -6.0426813E-01 -3.7605968E-01 -1.5681817E-01 -4.3212988E-02 15 3.5694466E+01 -2.7077720E-04 -1.0279783E-01 4.4434453E-01 4.3890449E-01 2.0271629E-01 5.6571127E-02 16 1.8543018E+01 1.6040968E-04 1.6582482E-02 8.3006565E-01 1.0040523E+00 4.9049269E-01 1.3845860E-01 17 7.4692683E+00 -8.3838530E-05 -5.7839929E-03 1.1946425E-01 -5.9578824E-01 -4.2685586E-01 -1.2641927E-01 18 3.6765607E+00 4.6281662E-05 2.7102125E-03 -1.4651323E-02 -8.7378629E-01 -8.0089420E-01 -2.5069488E-01 19 1.0677454E+00 -1.6142349E-05 -8.7939127E-04 4.0230449E-03 -6.0570776E-02 7.0044677E-01 2.8129722E-01 20 4.8782008E-01 7.8155542E-06 4.2517152E-04 -1.9203678E-03 1.4087769E-02 6.4840765E-01 4.2321248E-01 21 9.1800954E-02 -2.0294283E-06 -1.0906551E-04 4.6776073E-04 -2.8647973E-03 3.0419774E-02 -6.1988757E-01 22 3.5802468E-02 8.9482921E-07 4.8112562E-05 -2.0416793E-04 1.2442608E-03 -5.5165759E-03 -5.7071701E-01 2p 3p 4p 5p 1 4.0818814E+06 5.4923096E-05 2.7710630E-05 1.3344653E-05 4.7060404E-06 2 6.0219881E+05 1.9071804E-04 9.6299799E-05 4.6382024E-05 1.6364845E-05 3 1.2441686E+05 6.2018983E-04 3.1432387E-04 1.5153100E-04 5.3417612E-05 4 3.1579943E+04 2.1069260E-03 1.0722670E-03 5.1734062E-04 1.8276601E-04 5 9.4564371E+03 7.7130940E-03 3.9707534E-03 1.9211949E-03 6.7704412E-04 6 3.2577399E+03 2.8159476E-02 1.4660329E-02 7.1098090E-03 2.5166752E-03 7 1.2563399E+03 9.1016799E-02 4.8897717E-02 2.3894994E-02 8.4309344E-03 8 5.2805546E+02 2.3123634E-01 1.2956844E-01 6.3942889E-02 2.2742739E-02 9 2.3611837E+02 3.9125558E-01 2.3463598E-01 1.1789454E-01 4.1701903E-02 10 1.1020386E+02 3.3774838E-01 1.4541292E-01 6.3360415E-02 2.2458671E-02 11 5.0964757E+01 9.4040662E-02 -3.4996317E-01 -2.6392383E-01 -1.0338524E-01 12 2.4805498E+01 -1.1589641E-03 -6.0539259E-01 -4.8255454E-01 -1.8369316E-01 13 1.1649667E+01 2.2634503E-03 -1.9045150E-01 2.0976560E-01 1.1585724E-01 14 5.5280209E+00 -1.3035528E-03 -1.2296203E-03 7.3335081E-01 4.2377426E-01 15 2.5241256E+00 5.6458892E-04 -3.4758575E-03 2.6920892E-01 4.7083213E-02 16 1.0287074E+00 -2.3398403E-04 1.1963069E-03 8.6219630E-03 -6.3465415E-01 17 4.0980111E-01 8.3579645E-05 -4.1157474E-04 1.1417467E-03 -4.9351634E-01 18 9.0990959E-02 -2.2327709E-05 1.1118599E-04 -2.9605973E-04 -4.1969683E-02 19 3.0582682E-02 8.7740013E-06 -4.3716901E-05 1.1104557E-04 8.6095194E-03 3d 4d 5d 1 3.3900482E+03 1.1727674E-03 5.7693243E-04 1.1656646E-04 2 9.2822504E+02 1.0177486E-02 5.0412299E-03 1.0179519E-03 3 3.4102047E+02 5.3079495E-02 2.6620576E-02 5.3934925E-03 4 1.4384093E+02 1.7858195E-01 9.1450244E-02 1.8552978E-02 5 6.5516490E+01 3.6896537E-01 1.8800572E-01 3.8215727E-02 6 3.1092296E+01 4.1074167E-01 1.6711542E-01 3.2122745E-02 7 1.4845188E+01 1.7603154E-01 -1.8997553E-01 -4.9409367E-02 8 6.9314405E+00 1.7396619E-02 -5.3740944E-01 -1.2969508E-01 9 3.0800094E+00 1.3415973E-03 -3.8218675E-01 -6.0648016E-02 10 1.1649710E+00 -1.1001785E-04 -6.1288780E-02 2.4349595E-01 11 3.9237627E-01 8.4832992E-05 2.3631762E-03 5.1714241E-01 12 1.1463976E-01 -2.4355924E-05 -9.9270160E-04 4.8712154E-01 4f 1 2.3315907E+02 4.5032733E-03 2 7.9064953E+01 3.3571281E-02 3 3.2348736E+01 1.2462775E-01 4 1.4367656E+01 2.7548543E-01 5 6.4498202E+00 3.7494450E-01 6 2.8021056E+00 3.4294825E-01 7 1.1260243E+00 2.0174167E-01 8 3.8547549E-01 5.3075859E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.8655750E+07 5.9127379E-06 2.2205986E-06 1.0488615E-06 5.1218412E-07 2.0177523E-07 5.5227592E-08 2 1.0162738E+07 4.6856196E-05 1.7574147E-05 8.3147420E-06 4.0564100E-06 1.5977830E-06 4.3735493E-07 3 2.6555530E+06 2.1627295E-04 8.1321668E-05 3.8409061E-05 1.8759108E-05 7.3903712E-06 2.0227930E-06 4 7.7479033E+05 8.6593334E-04 3.2532002E-04 1.5402317E-04 7.5131101E-05 2.9592967E-05 8.1005023E-06 5 2.4763412E+05 3.0680153E-03 1.1587165E-03 5.4741587E-04 2.6746666E-04 1.0537946E-04 2.8842725E-05 6 8.5154884E+04 9.9226829E-03 3.7579398E-03 1.7826463E-03 8.6960340E-04 3.4253381E-04 9.3764798E-05 7 3.1200957E+04 2.9180418E-02 1.1236365E-02 5.3221888E-03 2.6033537E-03 1.0259350E-03 2.8080173E-04 8 1.2078618E+04 7.7179774E-02 3.0444841E-02 1.4558457E-02 7.1105784E-03 2.8017004E-03 7.6699911E-04 9 4.9069917E+03 1.7506922E-01 7.3949272E-02 3.5544990E-02 1.7466453E-02 6.8899993E-03 1.8859429E-03 10 2.0797575E+03 3.0874373E-01 1.4706605E-01 7.2973804E-02 3.5890086E-02 1.4164784E-02 3.8791023E-03 11 9.1548773E+02 3.3799381E-01 2.0280180E-01 1.0347816E-01 5.1866653E-02 2.0547817E-02 5.6258422E-03 12 4.1721154E+02 1.5327354E-01 2.7667520E-02 1.0526488E-02 3.7092387E-03 1.3404358E-03 3.6929357E-04 13 1.8530823E+02 1.2247566E-02 -4.8697738E-01 -4.0759958E-01 -2.2530716E-01 -9.1312270E-02 -2.5107121E-02 14 8.6777652E+01 1.2377289E-04 -5.5944683E-01 -6.0497324E-01 -3.7621341E-01 -1.5685452E-01 -4.3222296E-02 15 3.5694466E+01 -3.0204767E-04 -1.0357963E-01 4.4233138E-01 4.3603827E-01 2.0130269E-01 5.6173230E-02 16 1.8543018E+01 1.8654007E-04 1.6559611E-02 8.3183519E-01 1.0046873E+00 4.9073173E-01 1.3852261E-01 17 7.4692683E+00 -1.0090800E-04 -5.6971312E-03 1.1953981E-01 -5.9549344E-01 -4.2640451E-01 -1.2627509E-01 18 3.6765607E+00 5.7196662E-05 2.6345251E-03 -1.4559703E-02 -8.7412028E-01 -8.0096567E-01 -2.5071404E-01 19 1.0677454E+00 -2.2221787E-05 -8.2260807E-04 3.9541460E-03 -6.0623306E-02 7.0039933E-01 2.8125933E-01 20 4.8782008E-01 1.1994951E-05 3.8134394E-04 -1.8678992E-03 1.4112299E-02 6.4846695E-01 4.2322565E-01 21 9.1800954E-02 -4.2605675E-06 -8.2362580E-05 4.3617704E-04 -2.8762813E-03 3.0410636E-02 -6.1988878E-01 22 3.5802468E-02 2.5137668E-06 2.7858096E-05 -1.8029591E-04 1.2523396E-03 -5.5090872E-03 -5.7071722E-01 2p 3p 4p 5p 1 4.0818814E+06 1.2721576E-06 6.4439967E-07 3.1064919E-07 1.0934400E-07 2 6.0219881E+05 1.4476021E-05 7.3203961E-06 3.5262991E-06 1.2473976E-06 3 1.2441686E+05 1.2180030E-04 6.2069494E-05 2.9964075E-05 1.0542003E-05 4 3.1579943E+04 8.6085050E-04 4.3822335E-04 2.1141359E-04 7.4800931E-05 5 9.4564371E+03 4.9748949E-03 2.5584617E-03 1.2376353E-03 4.3577110E-04 6 3.2577399E+03 2.3028322E-02 1.1938952E-02 5.7842562E-03 2.0479108E-03 7 1.2563399E+03 8.3257487E-02 4.4533100E-02 2.1741106E-02 7.6678868E-03 8 5.2805546E+02 2.2275278E-01 1.2430498E-01 6.1289091E-02 2.1797242E-02 9 2.3611837E+02 3.8582819E-01 2.3081452E-01 1.1592591E-01 4.0999890E-02 10 1.1020386E+02 3.3558922E-01 1.4504798E-01 6.3422427E-02 2.2498014E-02 11 5.0964757E+01 9.1610559E-02 -3.4906250E-01 -2.6268520E-01 -1.0286809E-01 12 2.4805498E+01 -3.5843546E-03 -6.0601562E-01 -4.8254140E-01 -1.8367714E-01 13 1.1649667E+01 -1.2439443E-05 -1.9089505E-01 2.0906178E-01 1.1549274E-01 14 5.5280209E+00 -2.9630374E-03 -1.3057820E-03 7.3318385E-01 4.2362430E-01 15 2.5241256E+00 -1.2054394E-03 -3.5565658E-03 2.6901550E-01 4.7060257E-02 16 1.0287074E+00 -1.5084000E-03 1.1402194E-03 8.4213361E-03 -6.3467669E-01 17 4.0980111E-01 -1.4142901E-03 -4.7654711E-04 9.0208303E-04 -4.9357519E-01 18 9.0990959E-02 -1.3237316E-03 5.3470477E-05 -5.0420360E-04 -4.2005907E-02 19 3.0582682E-02 -7.5486133E-04 -7.6698140E-05 -1.1216001E-05 8.5874583E-03 3d 4d 5d 1 3.3900482E+03 8.8010120E-04 4.3270852E-04 8.7439518E-05 2 9.2822504E+02 9.2558345E-03 4.5807768E-03 9.2480387E-04 3 3.4102047E+02 5.1103833E-02 2.5607528E-02 5.1877055E-03 4 1.4384093E+02 1.7590908E-01 9.0022840E-02 1.8261616E-02 5 6.5516490E+01 3.6680661E-01 1.8684826E-01 3.7979145E-02 6 3.1092296E+01 4.0993099E-01 1.6689874E-01 3.2089589E-02 7 1.4845188E+01 1.7571887E-01 -1.8960233E-01 -4.9308066E-02 8 6.9314405E+00 1.7112835E-02 -5.3721020E-01 -1.2963586E-01 9 3.0800094E+00 1.1539959E-03 -3.8214293E-01 -6.0652512E-02 10 1.1649710E+00 -2.2100463E-04 -6.1246180E-02 2.4346927E-01 11 3.9237627E-01 3.3862977E-05 2.3897117E-03 5.1712958E-01 12 1.1463976E-01 -5.1452012E-05 -9.7976119E-04 4.8711611E-01 4f 1 2.3315907E+02 4.3435545E-03 2 7.9064953E+01 3.3195953E-02 3 3.2348736E+01 1.2408331E-01 4 1.4367656E+01 2.7503941E-01 5 6.4498202E+00 3.7469517E-01 6 2.8021056E+00 3.4285779E-01 7 1.1260243E+00 2.0171018E-01 8 3.8547549E-01 5.3068113E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 4.8655750E+07 4.7069455E-04 -1.7988496E-04 8.5214739E-05 4.1600269E-05 -1.6389205E-05 -4.4855156E-06 2 1.0162738E+07 1.2199601E-03 -4.6723441E-04 2.2137359E-04 1.0823344E-04 -4.2629724E-05 -1.1672793E-05 3 2.6555530E+06 2.6925734E-03 -1.0335971E-03 4.8994177E-04 2.3911334E-04 -9.4217140E-05 -2.5781897E-05 4 7.7479033E+05 5.6031867E-03 -2.1628902E-03 1.0263353E-03 5.0201645E-04 -1.9773006E-04 -5.4148294E-05 5 2.4763412E+05 1.1479060E-02 -4.4680458E-03 2.1225850E-03 1.0363722E-03 -4.0847033E-04 -1.1176847E-04 6 8.5154884E+04 2.3644169E-02 -9.3167502E-03 4.4419401E-03 2.1734627E-03 -8.5611913E-04 -2.3442465E-04 7 3.1200957E+04 4.9472402E-02 -1.9916936E-02 9.5112626E-03 4.6531906E-03 -1.8348201E-03 -5.0213169E-04 8 1.2078618E+04 1.0307895E-01 -4.2826387E-02 2.0642963E-02 1.0115894E-02 -3.9882263E-03 -1.0921835E-03 9 4.9069917E+03 2.0034935E-01 -8.9410907E-02 4.3353897E-02 2.1315812E-02 -8.4100258E-03 -2.3012891E-03 10 2.0797575E+03 3.2004989E-01 -1.6158237E-01 8.0866000E-02 3.9874711E-02 -1.5742833E-02 -4.3123187E-03 11 9.1548773E+02 3.2851150E-01 -2.0903563E-01 1.0752807E-01 5.3990766E-02 -2.1410975E-02 -5.8626783E-03 12 4.1721154E+02 1.4186384E-01 -2.0246811E-02 5.8397372E-03 1.2443092E-03 -3.4527753E-04 -9.6154261E-05 13 1.8530823E+02 1.0387814E-02 4.9398696E-01 -4.1750751E-01 -2.3138531E-01 9.3837910E-02 2.5804788E-02 14 8.6777652E+01 -1.5088955E-04 5.5535635E-01 -6.0492645E-01 -3.7665866E-01 1.5707635E-01 4.3283104E-02 15 3.5694466E+01 -2.6414951E-04 1.0201458E-01 4.4660293E-01 4.4078030E-01 -2.0356161E-01 -5.6807319E-02 16 1.8543018E+01 1.2228217E-04 -1.6705272E-02 8.3013873E-01 1.0043809E+00 -4.9069230E-01 -1.3851515E-01 17 7.4692683E+00 -8.1203615E-05 5.8383631E-03 1.1914937E-01 -5.9654748E-01 4.2731829E-01 1.2655457E-01 18 3.6765607E+00 3.7198131E-05 -2.7351560E-03 -1.4642715E-02 -8.7370417E-01 8.0087248E-01 2.5069158E-01 19 1.0677454E+00 -1.3262569E-05 8.7802169E-04 4.0333099E-03 -6.0526672E-02 -7.0053534E-01 -2.8133054E-01 20 4.8782008E-01 6.2710335E-06 -4.2518816E-04 -1.9270245E-03 1.4085409E-02 -6.4839109E-01 -4.2320881E-01 21 9.1800954E-02 -1.8810865E-06 1.0944760E-04 4.6731063E-04 -2.8679331E-03 -3.0416270E-02 6.1989265E-01 22 3.5802468E-02 7.9431022E-07 -4.8476430E-05 -2.0375080E-04 1.2458296E-03 5.5162042E-03 5.7071593E-01 2p 3p 4p 5p 1 4.0818814E+06 5.4003175E-05 -2.7079638E-05 1.3049808E-05 -4.5915439E-06 2 6.0219881E+05 1.9876239E-04 -9.9729601E-05 4.7906238E-05 -1.6939251E-05 3 1.2441686E+05 6.8428029E-04 -3.4607041E-04 1.6707922E-04 -5.8775185E-05 4 3.1579943E+04 2.3512731E-03 -1.1940931E-03 5.7535181E-04 -2.0354108E-04 5 9.4564371E+03 8.3881224E-03 -4.3147213E-03 2.0888996E-03 -7.3552022E-04 6 3.2577399E+03 2.9685820E-02 -1.5444774E-02 7.4877820E-03 -2.6517146E-03 7 1.2563399E+03 9.3883933E-02 -5.0445842E-02 2.4656605E-02 -8.6974721E-03 8 5.2805546E+02 2.3508152E-01 -1.3181279E-01 6.5059108E-02 -2.3143858E-02 9 2.3611837E+02 3.9397599E-01 -2.3661120E-01 1.1895122E-01 -4.2076327E-02 10 1.1020386E+02 3.3786393E-01 -1.4529350E-01 6.3275417E-02 -2.2434917E-02 11 5.0964757E+01 9.3590646E-02 3.5135131E-01 -2.6490710E-01 1.0377357E-01 12 2.4805498E+01 -1.2306231E-03 6.0575308E-01 -4.8295162E-01 1.8384581E-01 13 1.1649667E+01 2.2647710E-03 1.9023525E-01 2.1022984E-01 -1.1605785E-01 14 5.5280209E+00 -1.3066478E-03 1.2172568E-03 7.3346345E-01 -4.2386643E-01 15 2.5241256E+00 5.6445110E-04 3.4699090E-03 2.6916583E-01 -4.7036894E-02 16 1.0287074E+00 -2.3404059E-04 -1.1949225E-03 8.6157071E-03 6.3468441E-01 17 4.0980111E-01 8.3579019E-05 4.1092415E-04 1.1412196E-03 4.9351338E-01 18 9.0990959E-02 -2.2330157E-05 -1.1104998E-04 -2.9595062E-04 4.1968590E-02 19 3.0582682E-02 8.7739795E-06 4.3656356E-05 1.1102714E-04 -8.6095391E-03 3d 4d 5d 1 3.3900482E+03 1.2406763E-03 -6.0982204E-04 1.2320313E-04 2 9.2822504E+02 1.0444732E-02 -5.1732437E-03 1.0445888E-03 3 3.4102047E+02 5.3785660E-02 -2.6974407E-02 5.4652147E-03 4 1.4384093E+02 1.7975930E-01 -9.2067574E-02 1.8678585E-02 5 6.5516490E+01 3.7003285E-01 -1.8858051E-01 3.8334040E-02 6 3.1092296E+01 4.1108451E-01 -1.6724202E-01 3.2145626E-02 7 1.4845188E+01 1.7595391E-01 1.9026329E-01 -4.9477260E-02 8 6.9314405E+00 1.7376688E-02 5.3756599E-01 -1.2973523E-01 9 3.0800094E+00 1.3392112E-03 3.8218853E-01 -6.0643535E-02 10 1.1649710E+00 -1.0954358E-04 6.1280675E-02 2.4351303E-01 11 3.9237627E-01 8.4646783E-05 -2.3630321E-03 5.1714886E-01 12 1.1463976E-01 -2.4310815E-05 9.9261629E-04 4.8712243E-01 4f 1 2.3315907E+02 4.5517551E-03 2 7.9064953E+01 3.3719293E-02 3 3.2348736E+01 1.2486421E-01 4 1.4367656E+01 2.7570126E-01 5 6.4498202E+00 3.7504957E-01 6 2.8021056E+00 3.4297962E-01 7 1.1260243E+00 2.0174531E-01 8 3.8547549E-01 5.3075552E-02 ** Ta ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9215649E+07 1.8697080E-04 7.0690794E-05 3.3491815E-05 1.6402637E-05 6.5653606E-06 1.8458527E-06 2 1.0371476E+07 5.3373778E-04 2.0258819E-04 9.6087090E-05 4.7055204E-05 1.8834415E-05 5.2952998E-06 3 2.7290247E+06 1.3332246E-03 5.0944401E-04 2.4171727E-04 1.1844023E-04 4.7412221E-05 1.3330154E-05 4 8.0011793E+05 3.1501618E-03 1.2138723E-03 5.7728227E-04 2.8282217E-04 1.1321498E-04 3.1830889E-05 5 2.5660733E+05 7.3794490E-03 2.8823415E-03 1.3716805E-03 6.7280482E-04 2.6938578E-04 7.5741293E-05 6 8.8437510E+04 1.7289205E-02 6.8475445E-03 3.2726442E-03 1.6044833E-03 6.4240028E-04 1.8061837E-04 7 3.2447457E+04 4.0234210E-02 1.6320024E-02 7.8064507E-03 3.8360320E-03 1.5365104E-03 4.3203301E-04 8 1.2569665E+04 9.0506365E-02 3.7827222E-02 1.8260409E-02 8.9665545E-03 3.5914299E-03 1.0098288E-03 9 5.1075234E+03 1.8500003E-01 8.2824621E-02 4.0219028E-02 1.9857797E-02 7.9622069E-03 2.2391210E-03 10 2.1645198E+03 3.0670159E-01 1.5431004E-01 7.7217376E-02 3.8169752E-02 1.5312943E-02 4.3066265E-03 11 9.5258899E+02 3.2588953E-01 2.0434401E-01 1.0491032E-01 5.2783118E-02 2.1251058E-02 5.9796132E-03 12 4.3415841E+02 1.4728392E-01 2.4573998E-02 7.6706507E-03 2.1578340E-03 7.2250596E-04 1.9753096E-04 13 1.9259677E+02 1.2178075E-02 -4.8607394E-01 -4.1109649E-01 -2.2863218E-01 -9.4233507E-02 -2.6603200E-02 14 9.0177892E+01 1.8617357E-05 -5.5691582E-01 -6.0641815E-01 -3.7841918E-01 -1.6041148E-01 -4.5462925E-02 15 3.7179051E+01 -2.2452093E-04 -1.0438313E-01 4.3744734E-01 4.3456320E-01 2.0432479E-01 5.8756962E-02 16 1.9332682E+01 1.3320860E-04 1.6765492E-02 8.3389872E-01 1.0118647E+00 5.0329452E-01 1.4593052E-01 17 7.8227253E+00 -7.2351871E-05 -5.9285354E-03 1.2244270E-01 -5.8238501E-01 -4.2628158E-01 -1.2966908E-01 18 3.8688637E+00 4.1211774E-05 2.8030279E-03 -1.5049747E-02 -8.8553506E-01 -8.2986578E-01 -2.6956242E-01 19 1.1436875E+00 -1.4683824E-05 -9.2605972E-04 4.1849555E-03 -6.3254307E-02 7.0748342E-01 3.0267322E-01 20 5.2809080E-01 7.1224541E-06 4.4957073E-04 -2.0054311E-03 1.4609439E-02 6.5281947E-01 4.2561788E-01 21 1.0307763E-01 -1.8293190E-06 -1.1380105E-04 4.8137544E-04 -2.9145659E-03 3.1754107E-02 -6.1171107E-01 22 3.9442134E-02 7.8242230E-07 4.8700544E-05 -2.0335406E-04 1.2291343E-03 -5.1740969E-03 -5.8496453E-01 2p 3p 4p 5p 1 4.4541135E+06 5.4381967E-05 2.7511562E-05 1.3303635E-05 4.7988382E-06 2 6.6020069E+05 1.8812998E-04 9.5251093E-05 4.6063719E-05 1.6623791E-05 3 1.3648393E+05 6.0647757E-04 3.0814667E-04 1.4917655E-04 5.3791579E-05 4 3.4565087E+04 2.0326738E-03 1.0372218E-03 5.0239210E-04 1.8153204E-04 5 1.0301892E+04 7.3530071E-03 3.7939136E-03 1.8435795E-03 6.6458498E-04 6 3.5287532E+03 2.6739366E-02 1.3954113E-02 6.7924817E-03 2.4591713E-03 7 1.3536099E+03 8.6849533E-02 4.6708744E-02 2.2922011E-02 8.2729648E-03 8 5.6645771E+02 2.2353360E-01 1.2532940E-01 6.2045019E-02 2.2568962E-02 9 2.5240401E+02 3.8711868E-01 2.3210250E-01 1.1715050E-01 4.2399366E-02 10 1.1749142E+02 3.4684997E-01 1.5802494E-01 7.0777202E-02 2.5714219E-02 11 5.4384280E+01 1.0230199E-01 -3.2636546E-01 -2.4738728E-01 -9.9311850E-02 12 2.6482032E+01 -6.4329024E-04 -6.1159442E-01 -4.9298968E-01 -1.9269091E-01 13 1.2545067E+01 2.4319550E-03 -2.0710579E-01 1.6916809E-01 9.9375945E-02 14 5.9552140E+00 -1.3968875E-03 -3.7227793E-03 7.3752847E-01 4.3715265E-01 15 2.7410715E+00 6.0830261E-04 -3.2710159E-03 2.9244819E-01 7.2031466E-02 16 1.1158944E+00 -2.4982088E-04 1.1076533E-03 1.1174668E-02 -6.4376123E-01 17 4.4623388E-01 8.9603646E-05 -3.7746821E-04 9.0139675E-04 -4.9632679E-01 18 9.9590756E-02 -2.3543016E-05 1.0177581E-04 -2.3344378E-04 -4.1462905E-02 19 3.2748130E-02 9.0755270E-06 -3.9188878E-05 8.5845025E-05 8.2375876E-03 3d 4d 5d 1 3.4972698E+03 1.1894956E-03 5.8971015E-04 1.3193953E-04 2 9.5570091E+02 1.0299600E-02 5.1394998E-03 1.1429493E-03 3 3.5066715E+02 5.3681852E-02 2.7137615E-02 6.0880987E-03 4 1.4779151E+02 1.8045223E-01 9.3108599E-02 2.0800555E-02 5 6.7273674E+01 3.7157933E-01 1.9080005E-01 4.3035767E-02 6 3.1916972E+01 4.0979103E-01 1.6571359E-01 3.4438075E-02 7 1.5216288E+01 1.7241938E-01 -2.0007639E-01 -5.6345901E-02 8 7.1014289E+00 1.6302266E-02 -5.4260875E-01 -1.4836321E-01 9 3.1587591E+00 1.3499441E-03 -3.7287741E-01 -5.3798127E-02 10 1.1734593E+00 -1.5210731E-04 -5.4811985E-02 2.8708514E-01 11 4.1469920E-01 9.5460748E-05 3.1455309E-03 5.2545746E-01 12 1.2725984E-01 -2.9718277E-05 -1.1839085E-03 4.2537607E-01 4f 1 2.5803434E+02 3.9978832E-03 2 8.7561917E+01 3.0530472E-02 3 3.6008299E+01 1.1611385E-01 4 1.6094987E+01 2.6559950E-01 5 7.3092619E+00 3.7302323E-01 6 3.2308467E+00 3.4876549E-01 7 1.3330360E+00 2.0453004E-01 8 4.7476634E-01 5.2527747E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9215649E+07 6.0836270E-06 2.2949221E-06 1.0861190E-06 5.3205960E-07 2.1297042E-07 5.9876952E-08 2 1.0371476E+07 4.7907739E-05 1.8048312E-05 8.5556215E-06 4.1873541E-06 1.6758524E-06 4.7115892E-07 3 2.7290247E+06 2.1924648E-04 8.2806941E-05 3.9188627E-05 1.9200431E-05 7.6856752E-06 2.1608474E-06 4 8.0011793E+05 8.7210738E-04 3.2910052E-04 1.5611389E-04 7.6396847E-05 3.0574908E-05 8.5959907E-06 5 2.5660733E+05 3.0729856E-03 1.1657697E-03 5.5185661E-04 2.7048703E-04 1.0828027E-04 3.0443588E-05 6 8.8437510E+04 9.8976644E-03 3.7650077E-03 1.7894193E-03 8.7574005E-04 3.5049333E-04 9.8540019E-05 7 3.2447457E+04 2.9015305E-02 1.1220406E-02 5.3253498E-03 2.6130695E-03 1.0462941E-03 2.9418076E-04 8 1.2569665E+04 7.6589136E-02 3.0327375E-02 1.4528847E-02 7.1192677E-03 2.8502106E-03 8.0136266E-04 9 5.1075234E+03 1.7362537E-01 7.3542565E-02 3.5416538E-02 1.7456907E-02 6.9967654E-03 1.9675130E-03 10 2.1645198E+03 3.0677511E-01 1.4617884E-01 7.2631179E-02 3.5838187E-02 1.4371839E-02 4.0417197E-03 11 9.5258899E+02 3.3795295E-01 2.0193267E-01 1.0315135E-01 5.1843387E-02 2.0867652E-02 5.8715456E-03 12 4.3415841E+02 1.5557985E-01 2.9170004E-02 1.1122464E-02 4.0387890E-03 1.4939740E-03 4.1513693E-04 13 1.9259677E+02 1.2939387E-02 -4.8386594E-01 -4.0541845E-01 -2.2500263E-01 -9.2695613E-02 -2.6167315E-02 14 9.0177892E+01 3.0199058E-05 -5.6106041E-01 -6.0712499E-01 -3.7856115E-01 -1.6044195E-01 -4.5470616E-02 15 3.7179051E+01 -2.5433280E-04 -1.0520451E-01 4.3534228E-01 4.3157264E-01 2.0282435E-01 5.8322376E-02 16 1.9332682E+01 1.5903518E-04 1.6738784E-02 8.3573188E-01 1.0125122E+00 5.0353796E-01 1.4599732E-01 17 7.8227253E+00 -8.9848063E-05 -5.8348740E-03 1.2252906E-01 -5.8206373E-01 -4.2579229E-01 -1.2950772E-01 18 3.8688637E+00 5.2667438E-05 2.7210510E-03 -1.4955078E-02 -8.8588763E-01 -8.2994208E-01 -2.6958316E-01 19 1.1436875E+00 -2.1259574E-05 -8.6411025E-04 4.1127200E-03 -6.3312082E-02 7.0742991E-01 3.0262878E-01 20 5.2809080E-01 1.1681448E-05 4.0179333E-04 -1.9503924E-03 1.4636269E-02 6.5288586E-01 4.2563395E-01 21 1.0307763E-01 -4.2322553E-06 -8.5380045E-05 4.4898526E-04 -2.9268328E-03 3.1743916E-02 -6.1171284E-01 22 3.9442134E-02 2.4993459E-06 2.7525600E-05 -1.7930039E-04 1.2375938E-03 -5.1658846E-03 -5.8496443E-01 2p 3p 4p 5p 1 4.4541135E+06 1.2109685E-06 6.1491058E-07 2.9774797E-07 1.0720477E-07 2 6.6020069E+05 1.3601548E-05 6.8985808E-06 3.3354196E-06 1.2067771E-06 3 1.3648393E+05 1.1323128E-04 5.7843909E-05 2.8051824E-05 1.0095338E-05 4 3.4565087E+04 7.9699540E-04 4.0693251E-04 1.9704956E-04 7.1311049E-05 5 1.0301892E+04 4.6229026E-03 2.3830899E-03 1.1579906E-03 4.1706661E-04 6 3.5287532E+03 2.1580292E-02 1.1215263E-02 5.4534495E-03 1.9748389E-03 7 1.3536099E+03 7.8951662E-02 4.2270154E-02 2.0723865E-02 7.4764765E-03 8 5.6645771E+02 2.1473255E-01 1.1988504E-01 5.9291891E-02 2.1565774E-02 9 2.5240401E+02 3.8131590E-01 2.2802198E-01 1.1503837E-01 4.1628628E-02 10 1.1749142E+02 3.4456359E-01 1.5751482E-01 7.0756102E-02 2.5723631E-02 11 5.4384280E+01 9.9837213E-02 -3.2539693E-01 -2.4609397E-01 -9.8760227E-02 12 2.6482032E+01 -3.1463653E-03 -6.1218939E-01 -4.9290134E-01 -1.9263973E-01 13 1.2545067E+01 8.6281479E-05 -2.0759469E-01 1.6842628E-01 9.8986202E-02 14 5.9552140E+00 -3.1279731E-03 -3.8024972E-03 7.3733657E-01 4.3697771E-01 15 2.7410715E+00 -1.2197919E-03 -3.3541852E-03 2.9225636E-01 7.2009570E-02 16 1.1158944E+00 -1.5895911E-03 1.0510974E-03 1.0963057E-02 -6.4378471E-01 17 4.4623388E-01 -1.4625945E-03 -4.4395465E-04 6.5149132E-04 -4.9638953E-01 18 9.9590756E-02 -1.3884748E-03 4.2942870E-05 -4.5325573E-04 -4.1501094E-02 19 3.2748130E-02 -7.9944503E-04 -7.3601842E-05 -4.4390848E-05 8.2140589E-03 3d 4d 5d 1 3.4972698E+03 8.8648406E-04 4.3926058E-04 9.8375488E-05 2 9.5570091E+02 9.3427513E-03 4.6578270E-03 1.0353865E-03 3 3.5066715E+02 5.1630719E-02 2.6077467E-02 5.8501165E-03 4 1.4779151E+02 1.7767983E-01 9.1616132E-02 2.0464253E-02 5 6.7273674E+01 3.6935339E-01 1.8959780E-01 4.2763893E-02 6 3.1916972E+01 4.0896651E-01 1.6550401E-01 3.4405166E-02 7 1.5216288E+01 1.7209521E-01 -1.9968202E-01 -5.6227582E-02 8 7.1014289E+00 1.6010761E-02 -5.4240660E-01 -1.4829478E-01 9 3.1587591E+00 1.1550993E-03 -3.7283299E-01 -5.3807388E-02 10 1.1734593E+00 -2.6597797E-04 -5.4767245E-02 2.8705356E-01 11 4.1469920E-01 4.6847684E-05 3.1712885E-03 5.2544478E-01 12 1.2725984E-01 -5.9732010E-05 -1.1694845E-03 4.2537006E-01 4f 1 2.5803434E+02 3.8420846E-03 2 8.7561917E+01 3.0150633E-02 3 3.6008299E+01 1.1554445E-01 4 1.6094987E+01 2.6511003E-01 5 7.3092619E+00 3.7274138E-01 6 3.2308467E+00 3.4866044E-01 7 1.3330360E+00 2.0449428E-01 8 4.7476634E-01 5.2517908E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 4.9215649E+07 4.9434015E-04 -1.8977745E-04 9.0081417E-05 4.4116062E-05 -1.7660010E-05 -4.9651286E-06 2 1.0371476E+07 1.2730627E-03 -4.8978801E-04 2.3251245E-04 1.1404520E-04 -4.5638358E-05 -1.2833719E-05 3 2.7290247E+06 2.7921803E-03 -1.0766931E-03 5.1140543E-04 2.5037875E-04 -1.0024589E-04 -2.8182373E-05 4 8.0011793E+05 5.7739034E-03 -2.2390620E-03 1.0645311E-03 5.2239048E-04 -2.0904712E-04 -5.8787699E-05 5 2.5660733E+05 1.1751149E-02 -4.5954099E-03 2.1875722E-03 1.0714695E-03 -4.2911479E-04 -1.2063743E-04 6 8.8437510E+04 2.4026389E-02 -9.5140738E-03 4.5448286E-03 2.2311298E-03 -8.9289359E-04 -2.5106666E-04 7 3.2447457E+04 4.9881095E-02 -2.0183350E-02 9.6592396E-03 4.7404185E-03 -1.8993538E-03 -5.3403983E-04 8 1.2569665E+04 1.0319847E-01 -4.3090922E-02 2.0812164E-02 1.0233166E-02 -4.0992367E-03 -1.1528151E-03 9 5.1075234E+03 1.9963183E-01 -8.9461329E-02 4.3470463E-02 2.1438851E-02 -8.5946680E-03 -2.4162831E-03 10 2.1645198E+03 3.1856641E-01 -1.6113409E-01 8.0769541E-02 3.9961125E-02 -1.6030537E-02 -4.5089630E-03 11 9.5258899E+02 3.2839292E-01 -2.0841903E-01 1.0735953E-01 5.4054477E-02 -2.1781058E-02 -6.1296880E-03 12 4.3415841E+02 1.4375820E-01 -2.1584361E-02 6.3152684E-03 1.5029120E-03 -4.5303412E-04 -1.2100433E-04 13 1.9259677E+02 1.0954577E-02 4.9116277E-01 -4.1567720E-01 -2.3131858E-01 9.5363581E-02 2.6924093E-02 14 9.0177892E+01 -2.5026869E-04 5.5686147E-01 -6.0713673E-01 -3.7906084E-01 1.6069233E-01 4.5541768E-02 15 3.7179051E+01 -2.1833291E-04 1.0356334E-01 4.3979287E-01 4.3651040E-01 -2.0521688E-01 -5.9013656E-02 16 1.9332682E+01 9.3746467E-05 -1.6892331E-02 8.3398799E-01 1.0122271E+00 -5.0351695E-01 -1.4599519E-01 17 7.8227253E+00 -6.9639309E-05 5.9842441E-03 1.2211156E-01 -5.8318308E-01 4.2677600E-01 1.2981799E-01 18 3.8688637E+00 3.1737375E-05 -2.8288033E-03 -1.5041195E-02 -8.8545293E-01 8.2984707E-01 2.6956058E-01 19 1.1436875E+00 -1.1635287E-05 9.2447905E-04 4.1959748E-03 -6.3206089E-02 -7.0758165E-01 -3.0271202E-01 20 5.2809080E-01 5.4900479E-06 -4.4955388E-04 -2.0125764E-03 1.4606758E-02 -6.5280098E-01 -4.2561298E-01 21 1.0307763E-01 -1.6816570E-06 1.1420412E-04 4.8085972E-04 -2.9179687E-03 -3.1750142E-02 6.1171663E-01 22 3.9442134E-02 6.8234381E-07 -4.9082831E-05 -2.0289039E-04 1.2308274E-03 5.1736413E-03 5.8496340E-01 2p 3p 4p 5p 1 4.4541135E+06 5.3302664E-05 -2.6795309E-05 1.2969691E-05 -4.6679031E-06 2 6.6020069E+05 1.9541969E-04 -9.8326694E-05 4.7409221E-05 -1.7145464E-05 3 1.3648393E+05 6.6821149E-04 -3.3873677E-04 1.6427323E-04 -5.9112755E-05 4 3.4565087E+04 2.2725763E-03 -1.1572842E-03 5.5968166E-04 -2.0251254E-04 5 1.0301892E+04 8.0232829E-03 -4.1362981E-03 2.0114955E-03 -7.2449409E-04 6 3.5287532E+03 2.8262832E-02 -1.4739527E-02 7.1719167E-03 -2.5977978E-03 7 1.3536099E+03 8.9737127E-02 -4.8268174E-02 2.3693055E-02 -8.5490318E-03 8 5.6645771E+02 2.2748528E-01 -1.2763201E-01 6.3192271E-02 -2.2990502E-02 9 2.5240401E+02 3.9003543E-01 -2.3419552E-01 1.1827316E-01 -4.2806326E-02 10 1.1749142E+02 3.4706383E-01 -1.5800795E-01 7.0746609E-02 -2.5710473E-02 11 5.4384280E+01 1.0181647E-01 3.2780471E-01 -2.4839371E-01 9.9717826E-02 12 2.6482032E+01 -7.2350896E-04 6.1202726E-01 -4.9346384E-01 1.9287902E-01 13 1.2545067E+01 2.4314673E-03 2.0687453E-01 1.6965011E-01 -9.9587440E-02 14 5.9552140E+00 -1.3994665E-03 3.7074390E-03 7.3766500E-01 -4.3726268E-01 15 2.7410715E+00 6.0786669E-04 3.2634066E-03 2.9240270E-01 -7.1982036E-02 16 1.1158944E+00 -2.4976437E-04 -1.1057486E-03 1.1166865E-02 6.4379593E-01 17 4.4623388E-01 8.9549699E-05 3.7664795E-04 9.0084138E-04 4.9632328E-01 18 9.9590756E-02 -2.3529957E-05 -1.0161146E-04 -2.3331017E-04 4.1461725E-02 19 3.2748130E-02 9.0694712E-06 3.9118157E-05 8.5819014E-05 -8.2376142E-03 3d 4d 5d 1 3.4972698E+03 1.2601380E-03 -6.2422565E-04 1.3975392E-04 2 9.5570091E+02 1.0577475E-02 -5.2777220E-03 1.1734184E-03 3 3.5066715E+02 5.4415522E-02 -2.7508347E-02 6.1717507E-03 4 1.4779151E+02 1.8167433E-01 -9.3754232E-02 2.0944588E-02 5 6.7273674E+01 3.7268189E-01 -1.9139937E-01 4.3173644E-02 6 3.1916972E+01 4.1013666E-01 -1.6583628E-01 3.4460098E-02 7 1.5216288E+01 1.7233785E-01 2.0038008E-01 -5.6423235E-02 8 7.1014289E+00 1.6282386E-02 5.4276788E-01 -1.4841121E-01 9 3.1587591E+00 1.3475627E-03 3.7287711E-01 -5.3789412E-02 10 1.1734593E+00 -1.5161192E-04 5.4803892E-02 2.8710471E-01 11 4.1469920E-01 9.5261374E-05 -3.1454421E-03 5.2546400E-01 12 1.2725984E-01 -2.9671688E-05 1.1838695E-03 4.2537668E-01 4f 1 2.5803434E+02 4.0445780E-03 2 8.7561917E+01 3.0678337E-02 3 3.6008299E+01 1.1635905E-01 4 1.6094987E+01 2.6583607E-01 5 7.3092619E+00 3.7314455E-01 6 3.2308467E+00 3.4880308E-01 7 1.3330360E+00 2.0453416E-01 8 4.7476634E-01 5.2527297E-02 ** W ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9493396E+07 1.9705303E-04 7.4837753E-05 3.5524570E-05 1.7455080E-05 7.0918205E-06 2.0282703E-06 2 1.0529808E+07 5.5837381E-04 2.1290096E-04 1.0117163E-04 4.9707885E-05 2.0195906E-05 5.7759894E-06 3 2.7917950E+06 1.3841553E-03 5.3131994E-04 2.5258649E-04 1.2417091E-04 5.0454720E-05 1.4430422E-05 4 8.2297574E+05 3.2440821E-03 1.2558793E-03 5.9841176E-04 2.9414163E-04 1.1952078E-04 3.4182999E-05 5 2.6497295E+05 7.5371297E-03 2.9579870E-03 1.4105013E-03 6.9411037E-04 2.8210121E-04 8.0686520E-05 6 9.1562745E+04 1.7514411E-02 6.9714818E-03 3.3384653E-03 1.6422160E-03 6.6742642E-04 1.9088662E-04 7 3.3651601E+04 4.0454567E-02 1.6494153E-02 7.9063892E-03 3.8978701E-03 1.5847883E-03 4.5331634E-04 8 1.3048969E+04 9.0451020E-02 3.7997856E-02 1.8379344E-02 9.0554715E-03 3.6818389E-03 1.0530527E-03 9 5.3047313E+03 1.8415275E-01 8.2804521E-02 4.0292995E-02 1.9958818E-02 8.1231490E-03 2.3240090E-03 10 2.2483241E+03 3.0502145E-01 1.5380732E-01 7.7086975E-02 3.8234297E-02 1.5571121E-02 4.4542778E-03 11 9.8939259E+02 3.2534466E-01 2.0349996E-01 1.0460732E-01 5.2783421E-02 2.1569225E-02 6.1756403E-03 12 4.5097341E+02 1.4882299E-01 2.5307452E-02 7.7834196E-03 2.2193175E-03 7.5996460E-04 2.0714730E-04 13 1.9993609E+02 1.2717165E-02 -4.8348124E-01 -4.0957124E-01 -2.2873366E-01 -9.5753268E-02 -2.7494476E-02 14 9.3620117E+01 -5.0987516E-05 -5.5784201E-01 -6.0794224E-01 -3.8049851E-01 -1.6378357E-01 -4.7260947E-02 15 3.8693780E+01 -1.8771233E-04 -1.0576419E-01 4.3136960E-01 4.3109331E-01 2.0608485E-01 6.0422474E-02 16 2.0138186E+01 1.1162903E-04 1.6900113E-02 8.3714565E-01 1.0191499E+00 5.1583359E-01 1.5224929E-01 17 8.1851995E+00 -6.3224539E-05 -6.0547471E-03 1.2524454E-01 -5.6996315E-01 -4.2636396E-01 -1.3213568E-01 18 4.0679902E+00 3.7156916E-05 2.8857458E-03 -1.5415697E-02 -8.9663647E-01 -8.5763546E-01 -2.8566421E-01 19 1.2228791E+00 -1.3434227E-05 -9.6386800E-04 4.3103282E-03 -6.5627234E-02 7.1631223E-01 3.2129063E-01 20 5.6835185E-01 6.4853826E-06 4.6678533E-04 -2.0607875E-03 1.4926948E-02 6.5599207E-01 4.2398730E-01 21 1.1352791E-01 -1.6462162E-06 -1.1648882E-04 4.8690864E-04 -2.9258929E-03 3.2460918E-02 -6.0552121E-01 22 4.2712144E-02 6.8767016E-07 4.8687570E-05 -2.0044818E-04 1.2065176E-03 -4.8852296E-03 -5.9466636E-01 2p 3p 4p 5p 1 4.8422569E+06 5.3929075E-05 2.7354285E-05 1.3283841E-05 4.8913488E-06 2 7.2169973E+05 1.8589010E-04 9.4367238E-05 4.5827647E-05 1.6882244E-05 3 1.4937420E+05 5.9426492E-04 3.0268355E-04 1.4716180E-04 5.4170188E-05 4 3.7764362E+04 1.9657711E-03 1.0056911E-03 4.8909504E-04 1.8039261E-04 5 1.1207806E+04 7.0251681E-03 3.6326951E-03 1.7730358E-03 6.5248438E-04 6 3.8181988E+03 2.5428820E-02 1.3301648E-02 6.4999467E-03 2.4020647E-03 7 1.4570277E+03 8.2934272E-02 4.4650598E-02 2.2006905E-02 8.1082720E-03 8 6.0710712E+02 2.1606762E-01 1.2122482E-01 6.0212635E-02 2.2354913E-02 9 2.6958495E+02 3.8258117E-01 2.2928103E-01 1.1624641E-01 4.2958804E-02 10 1.2516685E+02 3.5525941E-01 1.6968581E-01 7.7726020E-02 2.8872382E-02 11 5.8012110E+01 1.1083542E-01 -3.0248997E-01 -2.3077090E-01 -9.4778245E-02 12 2.8257508E+01 9.1688221E-05 -6.1613487E-01 -5.0156902E-01 -2.0080032E-01 13 1.3494141E+01 2.5538035E-03 -2.2443197E-01 1.2946614E-01 8.2440322E-02 14 6.3989712E+00 -1.4629545E-03 -6.6729807E-03 7.4008715E-01 4.4918251E-01 15 2.9639320E+00 6.3972832E-04 -2.9859891E-03 3.1490617E-01 9.5667242E-02 16 1.2051418E+00 -2.6058542E-04 9.9587799E-04 1.3704990E-02 -6.5221088E-01 17 4.8298797E-01 9.3676679E-05 -3.3414369E-04 6.7820129E-04 -4.9891550E-01 18 1.0768928E-01 -2.4181716E-05 9.0223465E-05 -1.7382943E-04 -4.0790051E-02 19 3.4720311E-02 9.1851898E-06 -3.4170908E-05 6.3056960E-05 7.9688269E-03 3d 4d 5d 1 3.6582313E+03 1.1752301E-03 5.8702851E-04 1.4169151E-04 2 9.9704691E+02 1.0157560E-02 5.1075152E-03 1.2233357E-03 3 3.6529249E+02 5.3060404E-02 2.7025770E-02 6.5412156E-03 4 1.5383911E+02 1.7905268E-01 9.3098648E-02 2.2402052E-02 5 7.0017501E+01 3.7046275E-01 1.9175942E-01 4.6700017E-02 6 3.3232237E+01 4.1060407E-01 1.6785881E-01 3.7392799E-02 7 1.5859414E+01 1.7407683E-01 -1.9912480E-01 -6.0545846E-02 8 7.4155575E+00 1.6695103E-02 -5.4384833E-01 -1.6234794E-01 9 3.3165471E+00 1.3448477E-03 -3.7201619E-01 -5.4271157E-02 10 1.2392813E+00 -1.6794446E-04 -5.3626206E-02 3.1348405E-01 11 4.4991367E-01 9.8028358E-05 3.2782389E-03 5.2941290E-01 12 1.4194723E-01 -3.2282338E-05 -1.2520976E-03 3.8824307E-01 4f 1 2.8199130E+02 3.6361043E-03 2 9.5729811E+01 2.8297284E-02 3 3.9526315E+01 1.0978641E-01 4 1.7753859E+01 2.5797205E-01 5 8.1354884E+00 3.7156607E-01 6 3.6446495E+00 3.5329043E-01 7 1.5340321E+00 2.0613477E-01 8 5.6143065E-01 5.1576842E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9493396E+07 6.2950244E-06 2.3852869E-06 1.1310632E-06 5.5587986E-07 2.2585384E-07 6.4595948E-08 2 1.0529808E+07 4.9240289E-05 1.8633428E-05 8.8496338E-06 4.3455150E-06 1.7653594E-06 5.0487287E-07 3 2.7917950E+06 2.2327855E-04 8.4708211E-05 4.0166122E-05 1.9743318E-05 8.0219097E-06 2.2943510E-06 4 8.2297574E+05 8.8184224E-04 3.3427351E-04 1.5886585E-04 7.8000373E-05 3.1687230E-05 9.0620802E-06 5 2.6497295E+05 3.0885704E-03 1.1769529E-03 5.5824034E-04 2.7450310E-04 1.1154112E-04 3.1902642E-05 6 9.1562745E+04 9.9016948E-03 3.7834074E-03 1.8015232E-03 8.8458834E-04 3.5937402E-04 1.0277479E-04 7 3.3651601E+04 2.8921701E-02 1.1232645E-02 5.3416276E-03 2.6295182E-03 1.0687142E-03 3.0568584E-04 8 1.3048969E+04 7.6150371E-02 3.0273069E-02 1.4528908E-02 7.1430252E-03 2.9028880E-03 8.3019544E-04 9 5.3047313E+03 1.7242703E-01 7.3251651E-02 3.5342102E-02 1.7475647E-02 7.1095446E-03 2.0339159E-03 10 2.2483241E+03 3.0498797E-01 1.4543396E-01 7.2359460E-02 3.5823044E-02 1.4583097E-02 4.1713635E-03 11 9.8939259E+02 3.3769260E-01 2.0099492E-01 1.0278494E-01 5.1807378E-02 2.1165030E-02 6.0597140E-03 12 4.5097341E+02 1.5746050E-01 3.0031192E-02 1.1338828E-02 4.1639240E-03 1.5697758E-03 4.3958286E-04 13 1.9993609E+02 1.3539461E-02 -4.8116271E-01 -4.0368546E-01 -2.2495866E-01 -9.4128536E-02 -2.7025895E-02 14 9.3620117E+01 -4.3400670E-05 -5.6212263E-01 -6.0865301E-01 -3.8063048E-01 -1.6380877E-01 -4.7267086E-02 15 3.8693780E+01 -2.1658449E-04 -1.0662680E-01 4.2917159E-01 4.2797481E-01 2.0449455E-01 5.9953201E-02 16 2.0138186E+01 1.3748491E-04 1.6870893E-02 8.3904389E-01 1.0198108E+00 5.1608139E-01 1.5231818E-01 17 8.1851995E+00 -8.1319553E-05 -5.9553176E-03 1.2534145E-01 -5.6961428E-01 -4.2583418E-01 -1.3195702E-01 18 4.0679902E+00 4.9243858E-05 2.7982189E-03 -1.5317607E-02 -8.9700849E-01 -8.5771738E-01 -2.8568677E-01 19 1.2228791E+00 -2.0512950E-05 -8.9755363E-04 4.2349149E-03 -6.5690394E-02 7.1625291E-01 3.2123982E-01 20 5.6835185E-01 1.1404945E-05 4.1585826E-04 -2.0035344E-03 1.4955986E-02 6.5606547E-01 4.2400621E-01 21 1.1352791E-01 -4.2084865E-06 -8.6802332E-05 4.5386780E-04 -2.9389083E-03 3.2449695E-02 -6.0552353E-01 22 4.2712144E-02 2.4982337E-06 2.6859255E-05 -1.7622911E-04 1.2153639E-03 -4.8763069E-03 -5.9466596E-01 2p 3p 4p 5p 1 4.8422569E+06 1.1572904E-06 5.8905172E-07 2.8651659E-07 1.0531144E-07 2 7.2169973E+05 1.2828505E-05 6.5255518E-06 3.1672260E-06 1.1696865E-06 3 1.4937420E+05 1.0562329E-04 5.4084234E-05 2.6350630E-05 9.6807645E-06 4 3.7764362E+04 7.3974751E-04 3.7882268E-04 1.8414757E-04 6.8026362E-05 5 1.1207806E+04 4.3029547E-03 2.2232685E-03 1.0852948E-03 3.9902871E-04 6 3.8181988E+03 2.0243449E-02 1.0546045E-02 5.1475199E-03 1.9027386E-03 7 1.4570277E+03 7.4902242E-02 4.0140235E-02 1.9765014E-02 7.2790814E-03 8 6.0710712E+02 2.0695210E-01 1.1560176E-01 5.7360270E-02 2.1294076E-02 9 2.6958495E+02 3.7639294E-01 2.2493792E-01 1.1398809E-01 4.2117270E-02 10 1.2516685E+02 3.5283251E-01 1.6901756E-01 7.7613754E-02 2.8847439E-02 11 5.8012110E+01 1.0833995E-01 -3.0145723E-01 -2.2942640E-01 -9.4193496E-02 12 2.8257508E+01 -2.4913394E-03 -6.1669312E-01 -5.0139755E-01 -2.0070900E-01 13 1.3494141E+01 1.3605125E-04 -2.2496924E-01 1.2868686E-01 8.2025635E-02 14 6.3989712E+00 -3.2730512E-03 -6.7573883E-03 7.3986682E-01 4.4897987E-01 15 2.9639320E+00 -1.2469959E-03 -3.0716332E-03 3.1471628E-01 9.5646745E-02 16 1.2051418E+00 -1.6670674E-03 9.3901304E-04 1.3482133E-02 -6.5223541E-01 17 4.8298797E-01 -1.5165051E-03 -4.0227761E-04 4.1728322E-04 -4.9898212E-01 18 1.0768928E-01 -1.4577189E-03 3.0203322E-05 -4.0629321E-04 -4.0830331E-02 19 3.4720311E-02 -8.3860881E-04 -6.9720460E-05 -7.4370175E-05 7.9440341E-03 3d 4d 5d 1 3.6582313E+03 8.6704668E-04 4.3285954E-04 1.0461430E-04 2 9.9704691E+02 9.1787905E-03 4.6110993E-03 1.1038535E-03 3 3.6529249E+02 5.0953249E-02 2.5928516E-02 6.2756284E-03 4 1.5383911E+02 1.7618698E-01 9.1544195E-02 2.2024441E-02 5 7.0017501E+01 3.6814995E-01 1.9049981E-01 4.6392680E-02 6 3.3232237E+01 4.0974330E-01 1.6763564E-01 3.7355371E-02 7 1.5859414E+01 1.7374181E-01 -1.9871155E-01 -6.0411379E-02 8 7.4155575E+00 1.6392974E-02 -5.4363630E-01 -1.6226928E-01 9 3.3165471E+00 1.1425555E-03 -3.7197100E-01 -5.4283665E-02 10 1.2392813E+00 -2.8674953E-04 -5.3579402E-02 3.1344761E-01 11 4.4991367E-01 4.8216355E-05 3.3049948E-03 5.2939976E-01 12 1.4194723E-01 -6.5048437E-05 -1.2362774E-03 3.8823634E-01 4f 1 2.8199130E+02 3.4823011E-03 2 9.5729811E+01 2.7911034E-02 3 3.9526315E+01 1.0919151E-01 4 1.7753859E+01 2.5744090E-01 5 8.1354884E+00 3.7125259E-01 6 3.6446495E+00 3.5317136E-01 7 1.5340321E+00 2.0609503E-01 8 5.6143065E-01 5.1564912E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 4.9493396E+07 5.2046934E-04 -2.0071942E-04 9.5460531E-05 4.6903294E-05 -1.9058906E-05 -5.4513214E-06 2 1.0529808E+07 1.3314988E-03 -5.1461600E-04 2.4476368E-04 1.2044871E-04 -4.8925728E-05 -1.3993726E-05 3 2.7917950E+06 2.9014306E-03 -1.1239372E-03 5.3489487E-04 2.6273275E-04 -1.0678013E-04 -3.0541916E-05 4 8.2297574E+05 5.9611674E-03 -2.3224421E-03 1.1062565E-03 5.4466310E-04 -2.2123527E-04 -6.3277300E-05 5 2.6497295E+05 1.2051789E-02 -4.7353040E-03 2.2586572E-03 1.1098840E-03 -4.5121349E-04 -1.2906340E-04 6 9.1562745E+04 2.4459572E-02 -9.7339578E-03 4.6587106E-03 2.2947062E-03 -9.3213856E-04 -2.6657263E-04 7 3.3651601E+04 5.0383595E-02 -2.0491507E-02 9.8272622E-03 4.8385124E-03 -1.9679253E-03 -5.6296485E-04 8 1.3048969E+04 1.0348417E-01 -4.3432795E-02 2.1018676E-02 1.0370100E-02 -4.2167468E-03 -1.2061476E-03 9 5.3047313E+03 1.9915194E-01 -8.9636409E-02 4.3646726E-02 2.1594530E-02 -8.7875100E-03 -2.5135381E-03 10 2.2483241E+03 3.1723067E-01 -1.6082431E-01 8.0743547E-02 4.0085034E-02 -1.6323336E-02 -4.6696446E-03 11 9.8939259E+02 3.2803336E-01 -2.0770983E-01 1.0713758E-01 5.4099455E-02 -2.2126526E-02 -6.3367093E-03 12 4.5097341E+02 1.4523847E-01 -2.2267584E-02 6.3985547E-03 1.5487698E-03 -4.7962787E-04 -1.2573076E-04 13 1.9993609E+02 1.1433759E-02 4.8873569E-01 -4.1429459E-01 -2.3151506E-01 9.6941707E-02 2.7837613E-02 14 9.3620117E+01 -3.3006939E-04 5.5781395E-01 -6.0871793E-01 -3.8118188E-01 1.6408689E-01 4.7347900E-02 15 3.8693780E+01 -1.8228797E-04 1.0490823E-01 4.3380306E-01 4.3311443E-01 -2.0702519E-01 -6.0698213E-02 16 2.0138186E+01 7.0988560E-05 -1.7031298E-02 8.3725141E-01 1.0195463E+00 -5.1607993E-01 -1.5232229E-01 17 8.1851995E+00 -6.0498584E-05 6.1117866E-03 1.2489688E-01 -5.7080101E-01 4.2689215E-01 1.3229800E-01 18 4.0679902E+00 2.7321895E-05 -2.9123485E-03 -1.5407303E-02 -8.9655464E-01 8.5761982E-01 2.8566385E-01 19 1.2228791E+00 -1.0242720E-05 9.6204002E-04 4.3221731E-03 -6.5574463E-02 -7.1642072E-01 -3.2133495E-01 20 5.6835185E-01 4.7839318E-06 -4.6670456E-04 -2.0684692E-03 1.4923726E-02 -6.5597145E-01 -4.2398107E-01 21 1.1352791E-01 -1.5022941E-06 1.1689870E-04 4.8636273E-04 -2.9294548E-03 -3.2456581E-02 6.0552717E-01 22 4.2712144E-02 5.8928236E-07 -4.9081760E-05 -1.9995426E-04 1.2082952E-03 4.8847176E-03 5.9466521E-01 2p 3p 4p 5p 1 4.8422569E+06 5.2697207E-05 -2.6555518E-05 1.2911387E-05 -4.7437580E-06 2 7.2169973E+05 1.9247380E-04 -9.7111559E-05 4.7005943E-05 -1.7351923E-05 3 1.4937420E+05 6.5375740E-04 -3.3216597E-04 1.6182307E-04 -5.9445368E-05 4 3.7764362E+04 2.2013432E-03 -1.1240278E-03 5.4569385E-04 -2.0154654E-04 5 1.1207806E+04 7.6908107E-03 -3.9735172E-03 1.9411641E-03 -7.1373679E-04 6 3.8181988E+03 2.6949755E-02 -1.4088232E-02 6.8810420E-03 -2.5441574E-03 7 1.4570277E+03 8.5840992E-02 -4.6220774E-02 2.2787229E-02 -8.3935402E-03 8 6.0710712E+02 2.2012220E-01 -1.2358402E-01 6.1390568E-02 -2.2796568E-02 9 2.6958495E+02 3.8569570E-01 -2.3149086E-01 1.1743475E-01 -4.3398556E-02 10 1.2516685E+02 3.5558178E-01 -1.6977909E-01 7.7754581E-02 -2.8891373E-02 11 5.8012110E+01 1.1031493E-01 3.0397567E-01 -2.3179731E-01 9.5200309E-02 12 2.8257508E+01 1.6731837E-06 6.1664595E-01 -5.0212497E-01 2.0102699E-01 13 1.3494141E+01 2.5511556E-03 2.2418705E-01 1.2996373E-01 -8.2661679E-02 14 6.3989712E+00 -1.4649106E-03 6.6538027E-03 7.4024960E-01 -4.4931198E-01 15 2.9639320E+00 6.3896633E-04 2.9766116E-03 3.1485853E-01 -9.5614741E-02 16 1.2051418E+00 -2.6041523E-04 -9.9340803E-04 1.3695480E-02 6.5225023E-01 17 4.8298797E-01 9.3567639E-05 3.3313960E-04 6.7764657E-04 4.9891140E-01 18 1.0768928E-01 -2.4152752E-05 -9.0029582E-05 -1.7367721E-04 4.0788793E-02 19 3.4720311E-02 9.1730898E-06 3.4089965E-05 6.3025127E-05 -7.9688613E-03 3d 4d 5d 1 3.6582313E+03 1.2472964E-03 -6.2250921E-04 1.5039094E-04 2 9.9704691E+02 1.0441332E-02 -5.2497633E-03 1.2570249E-03 3 3.6529249E+02 5.3812421E-02 -2.7408608E-02 6.6345604E-03 4 1.5383911E+02 1.8031303E-01 -9.3769602E-02 2.2563074E-02 5 7.0017501E+01 3.7160908E-01 -1.9238753E-01 4.6856386E-02 6 3.3232237E+01 4.1096773E-01 -1.6799040E-01 3.7417670E-02 7 1.5859414E+01 1.7399262E-01 1.9944227E-01 -6.0632635E-02 8 7.4155575E+00 1.6673998E-02 5.4401588E-01 -1.6240376E-01 9 3.3165471E+00 1.3422964E-03 3.7201549E-01 -5.4259913E-02 10 1.2392813E+00 -1.6740175E-04 5.3617542E-02 3.1350659E-01 11 4.4991367E-01 9.7806532E-05 -3.2781739E-03 5.2941971E-01 12 1.4194723E-01 -3.2231236E-05 1.2520734E-03 3.8824350E-01 4f 1 2.8199130E+02 3.6817356E-03 2 9.5729811E+01 2.8445982E-02 3 3.9526315E+01 1.1004077E-01 4 1.7753859E+01 2.5822829E-01 5 8.1354884E+00 3.7170319E-01 6 3.6446495E+00 3.5333408E-01 7 1.5340321E+00 2.0613928E-01 8 5.6143065E-01 5.1576234E-02 ** Re ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9752613E+07 2.0770498E-04 7.9240894E-05 3.7684901E-05 1.8577974E-05 7.6540872E-06 2.2138403E-06 2 1.0683831E+07 5.8426055E-04 2.2379091E-04 1.0654465E-04 5.2522030E-05 2.1639247E-05 6.2587514E-06 3 2.8539833E+06 1.4374056E-03 5.5430051E-04 2.6400953E-04 1.3021702E-04 5.3654788E-05 1.5519294E-05 4 8.4587464E+05 3.3419441E-03 1.2998329E-03 6.2051877E-04 3.0602813E-04 1.2609974E-04 3.6472243E-05 5 2.7341819E+05 7.7014345E-03 3.0370007E-03 1.4510044E-03 7.1641314E-04 2.9525554E-04 8.5404999E-05 6 9.4734216E+04 1.7750835E-02 7.1012061E-03 3.4071404E-03 1.6816608E-03 6.9308205E-04 2.0046383E-04 7 3.4877933E+04 4.0694675E-02 1.6678258E-02 8.0110722E-03 3.9626194E-03 1.6337393E-03 4.7261532E-04 8 1.3538220E+04 9.0430450E-02 3.8185699E-02 1.8506146E-02 9.1491299E-03 3.7724019E-03 1.0911343E-03 9 5.5062908E+03 1.8335754E-01 8.2810978E-02 4.0377895E-02 2.0066829E-02 8.2816869E-03 2.3962838E-03 10 2.3340177E+03 3.0337473E-01 1.5333306E-01 7.6967065E-02 3.8305226E-02 1.5820836E-02 4.5766882E-03 11 1.0270152E+03 3.2473647E-01 2.0262654E-01 1.0427995E-01 5.2774676E-02 2.1865762E-02 6.3323141E-03 12 4.6814112E+02 1.5026399E-01 2.5861748E-02 7.7884705E-03 2.2197241E-03 7.7406429E-04 2.1105990E-04 13 2.0745113E+02 1.3243295E-02 -4.8099247E-01 -4.0813915E-01 -2.2888662E-01 -9.7229299E-02 -2.8235212E-02 14 9.7146276E+01 -1.1661229E-04 -5.5860454E-01 -6.0922378E-01 -3.8247630E-01 -1.6699975E-01 -4.8763316E-02 15 4.0249039E+01 -1.5235686E-04 -1.0708953E-01 4.2552217E-01 4.2788300E-01 2.0773099E-01 6.1695167E-02 16 2.0964989E+01 9.0721310E-05 1.7018392E-02 8.4018808E-01 1.0262552E+00 5.2815648E-01 1.5782122E-01 17 8.5575880E+00 -5.4168278E-05 -6.1746339E-03 1.2798137E-01 -5.5812418E-01 -4.2669317E-01 -1.3408815E-01 18 4.2743559E+00 3.3027923E-05 2.9647792E-03 -1.5778133E-02 -9.0730021E-01 -8.8430194E-01 -2.9979382E-01 19 1.3054091E+00 -1.2071142E-05 -9.9639007E-04 4.4145802E-03 -6.7799003E-02 7.2571941E-01 3.3759468E-01 20 6.0905465E-01 5.7718355E-06 4.7940640E-04 -2.0976707E-03 1.5106686E-02 6.5871831E-01 4.2035628E-01 21 1.2346220E-01 -1.4488525E-06 -1.1794755E-04 4.8779690E-04 -2.9145132E-03 3.2780281E-02 -6.0070832E-01 22 4.5751293E-02 5.9404062E-07 4.8381333E-05 -1.9666775E-04 1.1810358E-03 -4.6479662E-03 -6.0142755E-01 2p 3p 4p 5p 1 5.2550019E+06 5.3500786E-05 2.7206924E-05 1.3269304E-05 4.9786223E-06 2 7.8796148E+05 1.8376815E-04 9.3532899E-05 4.5616045E-05 1.7122580E-05 3 1.6334535E+05 5.8273330E-04 2.9752296E-04 1.4528250E-04 5.4493696E-05 4 4.1240829E+04 1.9030219E-03 9.7606755E-04 4.7665148E-04 1.7912615E-04 5 1.2191800E+04 6.7171624E-03 3.4807747E-03 1.7064609E-03 6.3992558E-04 6 4.1315403E+03 2.4185862E-02 1.2681131E-02 6.2212643E-03 2.3425302E-03 7 1.5684536E+03 7.9162111E-02 4.2663388E-02 2.1119480E-02 7.9292117E-03 8 6.5069880E+02 2.0865986E-01 1.1714784E-01 5.8387359E-02 2.2085261E-02 9 2.8794482E+02 3.7755824E-01 2.2611849E-01 1.1515036E-01 4.3370969E-02 10 1.3335567E+02 3.6315280E-01 1.8067140E-01 8.4360132E-02 3.1972561E-02 11 6.1909723E+01 1.1984589E-01 -2.7785801E-01 -2.1368355E-01 -8.9656266E-02 12 3.0158261E+01 1.0993938E-03 -6.1907913E-01 -5.0839108E-01 -2.0802434E-01 13 1.4509220E+01 2.6240302E-03 -2.4280441E-01 8.9804873E-02 6.4745750E-02 14 6.8635602E+00 -1.4998578E-03 -1.0144416E-02 7.4099490E-01 4.5973907E-01 15 3.1952322E+00 6.5805489E-04 -2.6191402E-03 3.3712974E-01 1.1881582E-01 16 1.2970608E+00 -2.6609782E-04 8.6017390E-04 1.6280595E-02 -6.5991539E-01 17 5.2039827E-01 9.5837294E-05 -2.8216021E-04 4.6304145E-04 -5.0160150E-01 18 1.1549167E-01 -2.4298461E-05 7.6859788E-05 -1.1616169E-04 -4.0049946E-02 19 3.6565102E-02 9.1211054E-06 -2.8707419E-05 4.1806947E-05 7.7586107E-03 3d 4d 5d 1 3.8353473E+03 1.1556412E-03 5.8156472E-04 1.4909067E-04 2 1.0424122E+03 9.9695902E-03 5.0516735E-03 1.2843023E-03 3 3.8131805E+02 5.2219308E-02 2.6795545E-02 6.8888372E-03 4 1.6046367E+02 1.7704295E-01 9.2763913E-02 2.3695856E-02 5 7.3027673E+01 3.6861597E-01 1.9234825E-01 4.9776626E-02 6 3.4678608E+01 4.1173130E-01 1.7070476E-01 4.0321217E-02 7 1.6573904E+01 1.7674866E-01 -1.9602589E-01 -6.3712645E-02 8 7.7678550E+00 1.7378079E-02 -5.4435666E-01 -1.7412066E-01 9 3.4963440E+00 1.3365306E-03 -3.7271553E-01 -5.6363141E-02 10 1.3216892E+00 -1.7794519E-04 -5.3510624E-02 3.3280816E-01 11 4.8898474E-01 9.8162809E-05 3.2092987E-03 5.3127665E-01 12 1.5722790E-01 -3.4026507E-05 -1.2780601E-03 3.6217375E-01 4f 1 3.0553627E+02 3.3597572E-03 2 1.0374563E+02 2.6553556E-02 3 4.2977330E+01 1.0480311E-01 4 1.9380492E+01 2.5177943E-01 5 8.9462673E+00 3.7041111E-01 6 4.0519492E+00 3.5702172E-01 7 1.7327633E+00 2.0708029E-01 8 6.4713929E-01 5.0491566E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9752613E+07 6.5176917E-06 2.4807931E-06 1.1785583E-06 5.8113490E-07 2.3942970E-07 6.9253910E-08 2 1.0683831E+07 5.0642718E-05 1.9250736E-05 9.1595782E-06 4.5127149E-06 1.8590695E-06 5.3767939E-07 3 2.8539833E+06 2.2753602E-04 8.6713916E-05 4.1194722E-05 2.0315714E-05 8.3703367E-06 2.4211113E-06 4 8.4587464E+05 8.9226439E-04 3.3976159E-04 1.6176956E-04 7.9691733E-05 3.2829894E-05 9.4948889E-06 5 2.7341819E+05 3.1060820E-03 1.1889934E-03 5.6502444E-04 2.7875371E-04 1.1485744E-04 3.3223323E-05 6 9.4734216E+04 9.9109344E-03 3.8040499E-03 1.8146466E-03 8.9402386E-04 3.6832159E-04 1.0652247E-04 7 3.4877933E+04 2.8841173E-02 1.1250295E-02 5.3602393E-03 2.6473350E-03 1.0910425E-03 3.1561074E-04 8 1.3538220E+04 7.5740605E-02 3.0230865E-02 1.4534045E-02 7.1696348E-03 2.9547777E-03 8.5456515E-04 9 5.5062908E+03 1.7127768E-01 7.2982849E-02 3.5276025E-02 1.7499444E-02 7.2189444E-03 2.0886748E-03 10 2.3340177E+03 3.0323463E-01 1.4471549E-01 7.2096877E-02 3.5812991E-02 1.4785168E-02 4.2767681E-03 11 1.0270152E+03 3.3737193E-01 2.0002973E-01 1.0239552E-01 5.1762786E-02 2.1440870E-02 6.2090514E-03 12 4.6814112E+02 1.5924828E-01 3.0716209E-02 1.1450851E-02 4.2305035E-03 1.6234310E-03 4.5766337E-04 13 2.0745113E+02 1.4128599E-02 -4.7856352E-01 -4.0204324E-01 -2.2496332E-01 -9.5515773E-02 -2.7735263E-02 14 9.7146276E+01 -1.1302073E-04 -5.6302264E-01 -6.0993823E-01 -3.8259789E-01 -1.6701931E-01 -4.8767745E-02 15 4.0249039E+01 -1.8027928E-04 -1.0799499E-01 4.2322905E-01 4.2463273E-01 2.0604793E-01 6.1192237E-02 16 2.0964989E+01 1.1661130E-04 1.6987001E-02 8.4215258E-01 1.0269294E+00 5.2840808E-01 1.5789156E-01 17 8.5575880E+00 -7.2883138E-05 -6.0695992E-03 1.2808929E-01 -5.5774606E-01 -4.2612021E-01 -1.3389171E-01 18 4.2743559E+00 4.5767687E-05 2.8717882E-03 -1.5676574E-02 -9.0769282E-01 -8.8439033E-01 -2.9981849E-01 19 1.3054091E+00 -1.9644581E-05 -9.2601111E-04 4.3362233E-03 -6.7867609E-02 7.2565452E-01 3.3753768E-01 20 6.0905465E-01 1.1031800E-05 4.2571057E-04 -2.0385419E-03 1.5137790E-02 6.5879862E-01 4.2037793E-01 21 1.2346220E-01 -4.1615011E-06 -8.7189720E-05 4.5424445E-04 -2.9282139E-03 3.2768089E-02 -6.0071115E-01 22 4.5751293E-02 2.4961497E-06 2.5987714E-05 -1.7231233E-04 1.1902464E-03 -4.6383720E-03 -6.0142686E-01 2p 3p 4p 5p 1 5.2550019E+06 1.1077753E-06 5.6514766E-07 2.7614477E-07 1.0342828E-07 2 7.8796148E+05 1.2118484E-05 6.1822271E-06 3.0124233E-06 1.1335407E-06 3 1.6334535E+05 9.8654245E-05 5.0629595E-05 2.4783330E-05 9.2780067E-06 4 4.1240829E+04 6.8701516E-04 3.5285233E-04 1.7220056E-04 6.4817495E-05 5 1.2191800E+04 4.0047204E-03 2.0737778E-03 1.0170227E-03 3.8103095E-04 6 4.1315403E+03 1.8978864E-02 9.9112255E-03 4.8564647E-03 1.8291082E-03 7 1.5684536E+03 7.1002946E-02 3.8085264E-02 1.8835406E-02 7.0684500E-03 8 6.5069880E+02 1.9923245E-01 1.1134865E-01 5.5436246E-02 2.0967029E-02 9 2.8794482E+02 3.7097026E-01 2.2150672E-01 1.1274183E-01 4.2456169E-02 10 1.3335567E+02 3.6056925E-01 1.7982810E-01 8.4146023E-02 3.1907758E-02 11 6.1909723E+01 1.1732423E-01 -2.7676526E-01 -2.1229238E-01 -8.9040353E-02 12 3.0158261E+01 -1.5661243E-03 -6.1959005E-01 -5.0812642E-01 -2.0788691E-01 13 1.4509220E+01 1.3111559E-04 -2.4339372E-01 8.8988889E-02 6.4306749E-02 14 6.8635602E+00 -3.3964227E-03 -1.0234834E-02 7.4074217E-01 4.5950564E-01 15 3.1952322E+00 -1.2878535E-03 -2.7072851E-03 3.3694230E-01 1.1879698E-01 16 1.2970608E+00 -1.7417804E-03 8.0313489E-04 1.6046096E-02 -6.5994105E-01 17 5.2039827E-01 -1.5748395E-03 -3.5202722E-04 1.9051507E-04 -5.0167203E-01 18 1.1549167E-01 -1.5303709E-03 1.5649854E-05 -3.6207646E-04 -4.0092408E-02 19 3.6565102E-02 -8.7446272E-04 -6.5206461E-05 -1.0235404E-04 7.7326940E-03 3d 4d 5d 1 3.8353473E+03 8.4336816E-04 4.2417635E-04 1.0889972E-04 2 1.0424122E+03 8.9716295E-03 4.5417280E-03 1.1539834E-03 3 3.8131805E+02 5.0059927E-02 2.5662802E-02 6.5976634E-03 4 1.6046367E+02 1.7408436E-01 9.1147004E-02 2.3278705E-02 5 7.3027673E+01 3.6621064E-01 1.9102708E-01 4.9434116E-02 6 3.4678608E+01 4.1082858E-01 1.7046286E-01 4.0277847E-02 7 1.6573904E+01 1.7640282E-01 -1.9559371E-01 -6.3562247E-02 8 7.7678550E+00 1.7064578E-02 -5.4413290E-01 -1.7403143E-01 9 3.4963440E+00 1.1267757E-03 -3.7266970E-01 -5.6378664E-02 10 1.3216892E+00 -3.0220515E-04 -5.3461723E-02 3.3276693E-01 11 4.8898474E-01 4.6047743E-05 3.2376121E-03 5.3126284E-01 12 1.5722790E-01 -6.9463531E-05 -1.2608641E-03 3.6216625E-01 4f 1 3.0553627E+02 3.2067899E-03 2 1.0374563E+02 2.6159720E-02 3 4.2977330E+01 1.0418224E-01 4 1.9380492E+01 2.5120749E-01 5 8.9462673E+00 3.7006630E-01 6 4.0519492E+00 3.5688888E-01 7 1.7327633E+00 2.0703673E-01 8 6.4713929E-01 5.0477523E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 4.9752613E+07 5.4801392E-04 -2.1231160E-04 1.0116435E-04 4.9870765E-05 -2.0549730E-05 -5.9445684E-06 2 1.0683831E+07 1.3927878E-03 -5.4078406E-04 2.5768630E-04 1.2722948E-04 -5.2405707E-05 -1.5157191E-05 3 2.8539833E+06 3.0154206E-03 -1.1734710E-03 5.5953471E-04 2.7574582E-04 -1.1364614E-04 -3.2877139E-05 4 8.4587464E+05 6.1556986E-03 -2.4094605E-03 1.1498165E-03 5.6800434E-04 -2.3395432E-04 -6.7663124E-05 5 2.7341819E+05 1.2363257E-02 -4.8808144E-03 2.3325680E-03 1.1499922E-03 -4.7410137E-04 -1.3716367E-04 6 9.4734216E+04 2.4909002E-02 -9.9624922E-03 4.7769243E-03 2.3609067E-03 -9.7249477E-04 -2.8122036E-04 7 3.4877933E+04 5.0911557E-02 -2.0813151E-02 1.0001840E-02 4.9407043E-03 -2.0377642E-03 -5.8961111E-04 8 1.3538220E+04 1.0381075E-01 -4.3796047E-02 2.1235241E-02 1.0513166E-02 -4.3351627E-03 -1.2539278E-03 9 5.5062908E+03 1.9872862E-01 -8.9841976E-02 4.3836082E-02 2.1758801E-02 -8.9786881E-03 -2.5975564E-03 10 2.3340177E+03 3.1593016E-01 -1.6054545E-01 8.0729455E-02 4.0216350E-02 -1.6608261E-02 -4.8043580E-03 11 1.0270152E+03 3.2761293E-01 -2.0697038E-01 1.0689060E-01 5.4135513E-02 -2.2450436E-02 -6.5036496E-03 12 4.6814112E+02 1.4662313E-01 -2.2770485E-02 6.3730080E-03 1.5326213E-03 -4.8265717E-04 -1.2515001E-04 13 2.0745113E+02 1.1898869E-02 4.8641414E-01 -4.1300723E-01 -2.3176492E-01 9.8477447E-02 2.8599630E-02 14 9.7146276E+01 -4.0591922E-04 5.5860344E-01 -6.1005733E-01 -3.8320244E-01 1.6732618E-01 4.8858172E-02 15 4.0249039E+01 -1.4787640E-04 1.0619674E-01 4.2804491E-01 4.2998008E-01 -2.0872077E-01 -6.1989058E-02 16 2.0964989E+01 4.8967739E-05 -1.7154061E-02 8.4031124E-01 1.0266868E+00 -5.2842820E-01 -1.5790292E-01 17 8.5575880E+00 -5.1471556E-05 6.2329705E-03 1.2761672E-01 -5.5900307E-01 4.2725683E-01 1.3426395E-01 18 4.2743559E+00 2.2851193E-05 -2.9921991E-03 -1.5769954E-02 -9.0721893E-01 8.8428949E-01 2.9979496E-01 19 1.3054091E+00 -8.7530672E-06 9.9427282E-04 4.4273226E-03 -6.7741274E-02 -7.2583873E-01 -3.3764463E-01 20 6.0905465E-01 4.0136616E-06 -4.7923190E-04 -2.1059360E-03 1.5102748E-02 -6.5869540E-01 -4.2034863E-01 21 1.2346220E-01 -1.3104570E-06 1.1835265E-04 4.8724845E-04 -2.9181551E-03 -3.2775633E-02 6.0071462E-01 22 4.5751293E-02 4.9800737E-07 -4.8782541E-05 -1.9615560E-04 1.1828708E-03 4.6474159E-03 6.0142637E-01 2p 3p 4p 5p 1 5.2550019E+06 5.2120833E-05 -2.6327348E-05 1.2858516E-05 -4.8141071E-06 2 7.8796148E+05 1.8967112E-04 -9.5957981E-05 4.6633100E-05 -1.7539352E-05 3 1.6334535E+05 6.3999944E-04 -3.2589593E-04 1.5950004E-04 -5.9706257E-05 4 4.1240829E+04 2.1340960E-03 -1.0925762E-03 5.3251672E-04 -2.0039673E-04 5 1.2191800E+04 7.3776073E-03 -3.8196984E-03 1.8746241E-03 -7.0237348E-04 6 4.1315403E+03 2.5703367E-02 -1.3468424E-02 6.6038651E-03 -2.4878462E-03 7 1.5684536E+03 8.2085113E-02 -4.4242823E-02 2.1908436E-02 -8.2231888E-03 8 6.5069880E+02 2.1281327E-01 -1.1956142E-01 5.9595240E-02 -2.2546553E-02 9 2.8794482E+02 3.8087396E-01 -2.2844505E-01 1.1640443E-01 -4.3843844E-02 10 1.3335567E+02 3.6359657E-01 -1.8088549E-01 8.4454147E-02 -3.2017616E-02 11 6.1909723E+01 1.1929110E-01 2.7938472E-01 -2.1472586E-01 9.0092375E-02 12 3.0158261E+01 9.9797309E-04 6.1967569E-01 -5.0903465E-01 2.0829318E-01 13 1.4509220E+01 2.6188019E-03 2.4254764E-01 9.0315164E-02 -6.4975549E-02 14 6.8635602E+00 -1.5010752E-03 1.0120299E-02 7.4118570E-01 -4.5988975E-01 15 3.1952322E+00 6.5693550E-04 2.6079057E-03 3.3708023E-01 -1.1876040E-01 16 1.2970608E+00 -2.6581514E-04 -8.5709509E-04 1.6269189E-02 6.5995966E-01 17 5.2039827E-01 9.5672270E-05 2.8095842E-04 4.6251433E-04 5.0159678E-01 18 1.1549167E-01 -2.4253384E-05 -7.6635477E-05 -1.1599547E-04 4.0048616E-02 19 3.6565102E-02 9.1029703E-06 2.8616279E-05 4.1770603E-05 -7.7586536E-03 3d 4d 5d 1 3.8353473E+03 1.2288627E-03 -6.1788220E-04 1.5856201E-04 2 1.0424122E+03 1.0258310E-02 -5.1975419E-03 1.3209360E-03 3 3.8131805E+02 5.2987821E-02 -2.7189624E-02 6.9909614E-03 4 1.6046367E+02 1.7834046E-01 -9.3459943E-02 2.3873106E-02 5 7.3027673E+01 3.6980856E-01 -1.9300675E-01 4.9950983E-02 6 3.4678608E+01 4.1211682E-01 -1.7084846E-01 4.0350096E-02 7 1.6573904E+01 1.7666206E-01 1.9635699E-01 -6.3808853E-02 8 7.7678550E+00 1.7355426E-02 5.4453421E-01 -1.7418434E-01 9 3.4963440E+00 1.3337583E-03 3.7271473E-01 -5.6349758E-02 10 1.3216892E+00 -1.7734570E-04 5.3501224E-02 3.3283382E-01 11 4.8898474E-01 9.7915353E-05 -3.2092451E-03 5.3128375E-01 12 1.5722790E-01 -3.3970023E-05 1.2780407E-03 3.6217406E-01 4f 1 3.0553627E+02 3.4047609E-03 2 1.0374563E+02 2.6703683E-02 3 4.2977330E+01 1.0506694E-01 4 1.9380492E+01 2.5205475E-01 5 8.9462673E+00 3.7056389E-01 6 4.0519492E+00 3.5707139E-01 7 1.7327633E+00 2.0708511E-01 8 6.4713929E-01 5.0490790E-02 ** Os ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9734245E+07 2.1956193E-04 8.4148018E-05 4.0091399E-05 1.9830281E-05 8.2768848E-06 2.4116434E-06 2 1.0785365E+07 6.1297715E-04 2.3587809E-04 1.1250334E-04 5.5645043E-05 2.3225973E-05 6.7672474E-06 3 2.9044775E+06 1.4964243E-03 5.7975115E-04 2.7664094E-04 1.3690282E-04 5.7147287E-05 1.6651489E-05 4 8.6596117E+05 3.4509487E-03 1.3486208E-03 6.4499210E-04 3.1916739E-04 1.3323609E-04 3.8820656E-05 5 2.8114397E+05 7.8874934E-03 3.1255417E-03 1.4961530E-03 7.4117523E-04 3.0945453E-04 9.0173164E-05 6 9.7711772E+04 1.8030135E-02 7.2498825E-03 3.4850459E-03 1.7259519E-03 7.2066502E-04 2.0997991E-04 7 3.6049748E+04 4.1019087E-02 1.6899979E-02 8.1338973E-03 4.0368712E-03 1.6861037E-03 4.9136806E-04 8 1.4011562E+04 9.0564727E-02 3.8445570E-02 1.8667864E-02 9.2607761E-03 3.8686288E-03 1.1272243E-03 9 5.7030543E+03 1.8279208E-01 8.2936717E-02 4.0520108E-02 2.0204671E-02 8.4474022E-03 2.4623235E-03 10 2.4182154E+03 3.0188578E-01 1.5299297E-01 7.6915584E-02 3.8410851E-02 1.6073900E-02 4.6842080E-03 11 1.0641369E+03 3.2391084E-01 2.0167130E-01 1.0390461E-01 5.2744720E-02 2.2135642E-02 6.4581709E-03 12 4.8510058E+02 1.5128485E-01 2.5780483E-02 7.4085060E-03 2.0103078E-03 7.0010217E-04 1.8988090E-04 13 2.1499882E+02 1.3673371E-02 -4.7891898E-01 -4.0716468E-01 -2.2930241E-01 -9.8752790E-02 -2.8894115E-02 14 1.0070916E+02 -1.6189515E-04 -5.5882416E-01 -6.0989905E-01 -3.8414752E-01 -1.6997043E-01 -5.0017849E-02 15 4.1833730E+01 -1.2769433E-04 -1.0819766E-01 4.2054457E-01 4.2554693E-01 2.0957908E-01 6.2778614E-02 16 2.1807054E+01 7.6429496E-05 1.7087248E-02 8.4263903E-01 1.0327858E+00 5.4002723E-01 1.6277989E-01 17 8.9389640E+00 -4.8130911E-05 -6.2755043E-03 1.3051884E-01 -5.4732257E-01 -4.2754657E-01 -1.3581477E-01 18 4.4871736E+00 3.0331166E-05 3.0338331E-03 -1.6107390E-02 -9.1723432E-01 -9.0962436E-01 -3.1229163E-01 19 1.3912146E+00 -1.1168350E-05 -1.0224887E-03 4.4950692E-03 -6.9769268E-02 7.3531359E-01 3.5196943E-01 20 6.5039440E-01 5.2772300E-06 4.8741348E-04 -2.1173485E-03 1.5170595E-02 6.6121055E-01 4.1568251E-01 21 1.3307065E-01 -1.3101498E-06 -1.1826461E-04 4.8470425E-04 -2.8856115E-03 3.2844746E-02 -5.9671232E-01 22 4.8637271E-02 5.2910329E-07 4.7777197E-05 -1.9206823E-04 1.1532314E-03 -4.4509264E-03 -6.0635879E-01 2p 3p 4p 5p 1 5.6818230E+06 5.3149681E-05 2.7096542E-05 1.3272837E-05 5.0662091E-06 2 8.5793427E+05 1.8193953E-04 9.2838571E-05 4.5471797E-05 1.7363830E-05 3 1.7824400E+05 5.7238786E-04 2.9292961E-04 1.4366454E-04 5.4821621E-05 4 4.4966509E+04 1.8459834E-03 9.4917795E-04 4.6545872E-04 1.7794056E-04 5 1.3247718E+04 6.4344529E-03 3.3411510E-03 1.6453143E-03 6.2771781E-04 6 4.4671193E+03 2.3029996E-02 1.2103197E-02 5.9615988E-03 2.2835133E-03 7 1.6873571E+03 7.5591452E-02 4.0780663E-02 2.0275926E-02 7.7447478E-03 8 6.9704165E+02 2.0143306E-01 1.1317094E-01 5.6603771E-02 2.1778665E-02 9 3.0741088E+02 3.7214040E-01 2.2269068E-01 1.1389571E-01 4.3650821E-02 10 1.4203009E+02 3.7036418E-01 1.9077739E-01 9.0555849E-02 3.4951924E-02 11 6.6063728E+01 1.2918655E-01 -2.5304179E-01 -1.9654782E-01 -8.4148749E-02 12 3.2173567E+01 2.3990544E-03 -6.2034094E-01 -5.1333049E-01 -2.1426719E-01 13 1.5580040E+01 2.6355423E-03 -2.6180847E-01 5.1133454E-02 4.6871469E-02 14 7.3437668E+00 -1.5054379E-03 -1.4046210E-02 7.4028926E-01 4.6885766E-01 15 3.4327942E+00 6.6263192E-04 -2.1856257E-03 3.5854653E-01 1.4106009E-01 16 1.3912969E+00 -2.6636852E-04 7.0685849E-04 1.8831479E-02 -6.6700548E-01 17 5.5845512E-01 9.6117312E-05 -2.2399197E-04 2.6260192E-04 -5.0417226E-01 18 1.2308776E-01 -2.3928776E-05 6.2392927E-05 -6.2171627E-05 -3.9264608E-02 19 3.8312312E-02 8.8942793E-06 -2.3011867E-05 2.2437299E-05 7.5795905E-03 3d 4d 5d 1 4.0203275E+03 1.1361739E-03 5.7601758E-04 1.5519830E-04 2 1.0896233E+03 9.7820052E-03 4.9946232E-03 1.3342389E-03 3 3.9795358E+02 5.1372567E-02 2.6555926E-02 7.1760201E-03 4 1.6732924E+02 1.7499221E-01 9.2391217E-02 2.4801754E-02 5 7.6144924E+01 3.6667980E-01 1.9287406E-01 5.2475902E-02 6 3.6176573E+01 4.1285276E-01 1.7361393E-01 4.3094985E-02 7 1.7315339E+01 1.7952945E-01 -1.9268597E-01 -6.6367293E-02 8 8.1348297E+00 1.8102147E-02 -5.4476153E-01 -1.8451652E-01 9 3.6854760E+00 1.3273667E-03 -3.7348334E-01 -5.8666395E-02 10 1.4115187E+00 -1.8631867E-04 -5.3635435E-02 3.4830568E-01 11 5.2982386E-01 9.7371104E-05 3.0440689E-03 5.3195655E-01 12 1.7280246E-01 -3.5462906E-05 -1.2813684E-03 3.4232628E-01 4f 1 3.2895741E+02 3.1392391E-03 2 1.1170925E+02 2.5134980E-02 3 4.6403320E+01 1.0072067E-01 4 2.0995110E+01 2.4657542E-01 5 9.7515337E+00 3.6946023E-01 6 4.4574969E+00 3.6021201E-01 7 1.9313762E+00 2.0763407E-01 8 7.3285164E-01 4.9393491E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 4.9734245E+07 6.7855900E-06 2.5944963E-06 1.2348271E-06 6.1090445E-07 2.5498327E-07 7.4297149E-08 2 1.0785365E+07 5.2353371E-05 1.9991789E-05 9.5291751E-06 4.7105446E-06 1.9659830E-06 5.7279477E-07 3 2.9044775E+06 2.3292235E-04 8.9171425E-05 4.2439962E-05 2.0999339E-05 8.7650066E-06 2.5539866E-06 4 8.6596117E+05 9.0640068E-04 3.4673020E-04 1.6538222E-04 8.1745161E-05 3.4117127E-05 9.9399422E-06 5 2.8114397E+05 3.1344408E-03 1.2053409E-03 5.7385420E-04 2.8404886E-04 1.1856714E-04 3.4549646E-05 6 9.7711772E+04 9.9493953E-03 3.8363199E-03 1.8332942E-03 9.0625585E-04 3.7825771E-04 1.1020272E-04 7 3.6049748E+04 2.8831685E-02 1.1296512E-02 5.3922893E-03 2.6719741E-03 1.1155620E-03 3.2508779E-04 8 1.4011562E+04 7.5480550E-02 3.0251862E-02 1.4569196E-02 7.2112913E-03 3.0109822E-03 8.7724050E-04 9 5.7030543E+03 1.7037040E-01 7.2829063E-02 3.5264268E-02 1.7550908E-02 7.3344927E-03 2.1378059E-03 10 2.4182154E+03 3.0166619E-01 1.4413650E-01 7.1904452E-02 3.5837866E-02 1.4990558E-02 4.3681522E-03 11 1.0641369E+03 3.3684569E-01 1.9899865E-01 1.0196777E-01 5.1701761E-02 2.1692005E-02 6.3285057E-03 12 4.8510058E+02 1.6060440E-01 3.0773104E-02 1.1187268E-02 4.0933774E-03 1.5917850E-03 4.5072874E-04 13 2.1499882E+02 1.4617829E-02 -4.7639047E-01 -4.0086169E-01 -2.2523057E-01 -9.6949693E-02 -2.8363953E-02 14 1.0070916E+02 -1.6103323E-04 -5.6337881E-01 -6.1062023E-01 -3.8426124E-01 -1.6998536E-01 -5.0020831E-02 15 4.1833730E+01 -1.5537814E-04 -1.0914748E-01 4.1815559E-01 4.2216141E-01 2.0780045E-01 6.2242569E-02 16 2.1807054E+01 1.0282511E-04 1.7055153E-02 8.4467139E-01 1.0334745E+00 5.4028280E-01 1.6285139E-01 17 8.9389640E+00 -6.7719949E-05 -6.1660913E-03 1.3063733E-01 -5.4691431E-01 -4.2692814E-01 -1.3560005E-01 18 4.4871736E+00 4.3864264E-05 2.9362786E-03 -1.6001866E-02 -9.1764829E-01 -9.0971997E-01 -3.1231872E-01 19 1.3912146E+00 -1.9275889E-05 -9.4884829E-04 4.4136785E-03 -6.9843510E-02 7.3524330E-01 3.5190634E-01 20 6.5039440E-01 1.0883914E-05 4.3166559E-04 -2.0564165E-03 1.5203740E-02 6.6129772E-01 4.1570683E-01 21 1.3307065E-01 -4.1721775E-06 -8.6806438E-05 4.5064284E-04 -2.8999975E-03 3.2831627E-02 -5.9671564E-01 22 4.8637271E-02 2.5237326E-06 2.5043542E-05 -1.6752810E-04 1.1628241E-03 -4.4406848E-03 -6.0635783E-01 2p 3p 4p 5p 1 5.6818230E+06 1.0643216E-06 5.4419643E-07 2.6712222E-07 1.0178658E-07 2 8.5793427E+05 1.1487443E-05 5.8770549E-06 2.8751834E-06 1.1005751E-06 3 1.7824400E+05 9.2424473E-05 4.7535596E-05 2.3377968E-05 8.9039190E-06 4 4.4966509E+04 6.3943990E-04 3.2937306E-04 1.6138521E-04 6.1797309E-05 5 1.3247718E+04 3.7319701E-03 1.9367169E-03 9.5422135E-04 3.6370958E-04 6 4.4671193E+03 1.7803792E-02 9.3201661E-03 4.5848703E-03 1.7566574E-03 7 1.6873571E+03 6.7310726E-02 3.6137684E-02 1.7950753E-02 6.8533670E-03 8 6.9704165E+02 1.9169798E-01 1.0719865E-01 5.3554669E-02 2.0603438E-02 9 3.0741088E+02 3.6514253E-01 2.1780683E-01 1.1133443E-01 4.2660900E-02 10 1.4203009E+02 3.6760789E-01 1.8974424E-01 9.0230591E-02 3.4842235E-02 11 6.6063728E+01 1.2664193E-01 -2.5189482E-01 -1.9511508E-01 -8.3503984E-02 12 3.2173567E+01 -3.5162479E-04 -6.2079470E-01 -5.1296422E-01 -2.1407838E-01 13 1.5580040E+01 6.3800149E-05 -2.6245256E-01 5.0282086E-02 4.6408998E-02 14 7.3437668E+00 -3.4946193E-03 -1.4143954E-02 7.4000076E-01 4.6859073E-01 15 3.4327942E+00 -1.3424320E-03 -2.2762053E-03 3.5836193E-01 1.4104318E-01 16 1.3912969E+00 -1.8126245E-03 6.4979241E-04 1.8585109E-02 -6.6703233E-01 17 5.5845512E-01 -1.6371661E-03 -2.9562856E-04 -2.2061252E-05 -5.0424669E-01 18 1.2308776E-01 -1.6053288E-03 3.3417697E-08 -3.2215346E-04 -3.9309311E-02 19 3.8312312E-02 -9.0837183E-04 -6.0328875E-05 -1.2820987E-04 7.5526496E-03 3d 4d 5d 1 4.0203275E+03 8.1998631E-04 4.1546729E-04 1.1211395E-04 2 1.0896233E+03 8.7652350E-03 4.4711981E-03 1.1936682E-03 3 3.9795358E+02 4.9161258E-02 2.5387462E-02 6.8603336E-03 4 1.6732924E+02 1.7193982E-01 9.0710634E-02 2.4345988E-02 5 7.6144924E+01 3.6417944E-01 1.9148907E-01 5.2098365E-02 6 3.6176573E+01 4.1190611E-01 1.7335168E-01 4.3045096E-02 7 1.7315339E+01 1.7917263E-01 -1.9223437E-01 -6.6200901E-02 8 8.1348297E+00 1.7777014E-02 -5.4452537E-01 -1.8441652E-01 9 3.6854760E+00 1.1101762E-03 -3.7343702E-01 -5.8685031E-02 10 1.4115187E+00 -3.1625430E-04 -5.3584360E-02 3.4825971E-01 11 5.2982386E-01 4.2455105E-05 3.0741910E-03 5.3194197E-01 12 1.7280246E-01 -7.3527059E-05 -1.2627910E-03 3.4231799E-01 4f 1 3.2895741E+02 2.9863454E-03 2 1.1170925E+02 2.4732765E-02 3 4.6403320E+01 1.0007342E-01 4 2.0995110E+01 2.4596311E-01 5 9.7515337E+00 3.6908408E-01 6 4.4574969E+00 3.6006550E-01 7 1.9313762E+00 2.0758680E-01 8 7.3285164E-01 4.9377297E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 4.9734245E+07 5.7840875E-04 -2.2512214E-04 1.0746514E-04 5.3153990E-05 -2.2189243E-05 -6.4664918E-06 2 1.0785365E+07 1.4601276E-03 -5.6956302E-04 2.7189032E-04 1.3469002E-04 -5.6204356E-05 -1.6374720E-05 3 2.9044775E+06 3.1401994E-03 -1.2277061E-03 5.8648047E-04 2.8999104E-04 -1.2108176E-04 -3.5289673E-05 4 8.6596117E+05 6.3684369E-03 -2.5045253E-03 1.1973339E-03 5.9346034E-04 -2.4763615E-04 -7.2141683E-05 5 2.8114397E+05 1.2705479E-02 -5.0400659E-03 2.4132098E-03 1.1937243E-03 -4.9857402E-04 -1.4532393E-04 6 9.7711772E+04 2.5411767E-02 -1.0215152E-02 4.9069806E-03 2.4334114E-03 -1.0154783E-03 -2.9578801E-04 7 3.6049748E+04 5.1534709E-02 -2.1178255E-02 1.0197513E-02 5.0541637E-03 -2.1118355E-03 -6.1560748E-04 8 1.4011562E+04 1.0430177E-01 -4.4237671E-02 2.1490032E-02 1.0676085E-02 -4.4601587E-03 -1.2995283E-03 9 5.7030543E+03 1.9853753E-01 -9.0171556E-02 4.4085625E-02 2.1955033E-02 -9.1779973E-03 -2.6750065E-03 10 2.4182154E+03 3.1477593E-01 -1.6040057E-01 8.0784285E-02 4.0382765E-02 -1.6896820E-02 -4.9236216E-03 11 1.0641369E+03 3.2696089E-01 -2.0613764E-01 1.0658948E-01 5.4147848E-02 -2.2746616E-02 -6.6389019E-03 12 4.8510058E+02 1.4758904E-01 -2.2629764E-02 5.9570241E-03 1.3032480E-03 -3.9633951E-04 -9.9439117E-05 13 2.1499882E+02 1.2269997E-02 4.8450579E-01 -4.1217963E-01 -2.3227972E-01 1.0006199E-01 2.9279233E-02 14 1.0070916E+02 -4.6081254E-04 5.5884709E-01 -6.1078647E-01 -3.8491489E-01 1.7031949E-01 5.0120167E-02 15 4.1833730E+01 -1.2447638E-04 1.0726862E-01 4.2315748E-01 4.2772266E-01 -2.1061985E-01 -6.3090212E-02 16 2.1807054E+01 3.3716573E-05 -1.7227735E-02 8.4277966E-01 1.0332525E+00 -5.4032505E-01 -1.6287047E-01 17 8.9389640E+00 -4.5524699E-05 6.3351426E-03 1.3013700E-01 -5.4824345E-01 4.2814727E-01 1.3600424E-01 18 4.4871736E+00 1.9842360E-05 -3.0620776E-03 -1.6099539E-02 -9.1715383E-01 9.0961517E-01 3.1229426E-01 19 1.3912146E+00 -7.7445260E-06 1.0200661E-03 4.5087695E-03 -6.9706229E-02 -7.3544428E-01 -3.5202510E-01 20 6.5039440E-01 3.4755122E-06 -4.8713228E-04 -2.1262335E-03 1.5165806E-02 -6.6118523E-01 -4.1567340E-01 21 1.3307065E-01 -1.1791984E-06 1.1865829E-04 4.8417474E-04 -2.8892721E-03 -3.2839830E-02 5.9671892E-01 22 4.8637271E-02 4.3610343E-07 -4.8182625E-05 -1.9154723E-04 1.1551036E-03 4.4503506E-03 6.0635759E-01 2p 3p 4p 5p 1 5.6818230E+06 5.1626577E-05 -2.6138051E-05 1.2823945E-05 -4.8845581E-06 2 8.5793427E+05 1.8720463E-04 -9.4964799E-05 4.6337895E-05 -1.7728860E-05 3 1.7824400E+05 6.2752831E-04 -3.2023649E-04 1.5745067E-04 -5.9963834E-05 4 4.4966509E+04 2.0726453E-03 -1.0638840E-03 5.2061023E-04 -1.9929739E-04 5 1.3247718E+04 7.0896346E-03 -3.6781042E-03 1.8134489E-03 -6.9126000E-04 6 4.4671193E+03 2.4544062E-02 -1.2891203E-02 6.3457796E-03 -2.4319071E-03 7 1.6873571E+03 7.8529029E-02 -4.2368564E-02 2.1073150E-02 -8.0470568E-03 8 6.9704165E+02 2.0568123E-01 -1.1563686E-01 5.7840966E-02 -2.2259137E-02 9 3.0741088E+02 3.7565837E-01 -2.2513280E-01 1.1521498E-01 -4.4156880E-02 10 1.4203009E+02 3.7094089E-01 -1.9112089E-01 9.0720673E-02 -3.5026021E-02 11 6.6063728E+01 1.2859916E-01 2.5460352E-01 -1.9760210E-01 8.4596877E-02 12 3.2173567E+01 2.2845216E-03 6.2102879E-01 -5.1406574E-01 2.1458103E-01 13 1.5580040E+01 2.6273393E-03 2.6154235E-01 5.1653125E-02 -4.7108102E-02 14 7.3437668E+00 -1.5058223E-03 1.4015979E-02 7.4051040E-01 -4.6903105E-01 15 3.4327942E+00 6.6112947E-04 2.1725310E-03 3.5849541E-01 -1.4100190E-01 16 1.3912969E+00 -2.6597873E-04 -7.0315030E-04 1.8818026E-02 6.6705492E-01 17 5.5845512E-01 9.5897785E-05 2.2258533E-04 2.6212620E-04 5.0416687E-01 18 1.2308776E-01 -2.3868040E-05 -6.2138559E-05 -6.1996031E-05 3.9263212E-02 19 3.8312312E-02 8.8703336E-06 2.2910993E-05 2.2397769E-05 -7.5796428E-03 3d 4d 5d 1 4.0203275E+03 1.2105129E-03 -6.1316129E-04 1.6538479E-04 2 1.0896233E+03 1.0075564E-02 -5.1440992E-03 1.3736678E-03 3 3.9795358E+02 5.2157360E-02 -2.6961252E-02 7.2864534E-03 4 1.6732924E+02 1.7632696E-01 -9.3112670E-02 2.4994808E-02 5 7.6144924E+01 3.6791974E-01 -1.9356391E-01 5.2668023E-02 6 3.6176573E+01 4.1326140E-01 -1.7377079E-01 4.3128389E-02 7 1.7315339E+01 1.7944054E-01 1.9303097E-01 -6.6472953E-02 8 8.1348297E+00 1.8077829E-02 5.4494970E-01 -1.8458815E-01 9 3.6854760E+00 1.3243500E-03 3.7348246E-01 -5.8650936E-02 10 1.4115187E+00 -1.8565718E-04 5.3625237E-02 3.4833455E-01 11 5.2982386E-01 9.7096465E-05 -3.0440226E-03 5.3196394E-01 12 1.7280246E-01 -3.5400636E-05 1.2813494E-03 3.4232649E-01 4f 1 3.2895741E+02 3.1839018E-03 2 1.1170925E+02 2.5286932E-02 3 4.6403320E+01 1.0099419E-01 4 2.0995110E+01 2.4686952E-01 5 9.7515337E+00 3.6962869E-01 6 4.4574969E+00 3.6026773E-01 7 1.9313762E+00 2.0763914E-01 8 7.3285164E-01 4.9392539E-02 ** Ir ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0217253E+07 2.3086203E-04 8.8886502E-05 4.2424000E-05 2.1054008E-05 8.8945965E-06 2.6036947E-06 2 1.0978438E+07 6.4009055E-04 2.4745540E-04 1.1823367E-04 5.8674942E-05 2.4788925E-05 7.2562853E-06 3 2.9762744E+06 1.5513955E-03 6.0385120E-04 2.8865738E-04 1.4332592E-04 6.0556482E-05 1.7727019E-05 4 8.9166997E+05 3.5503334E-03 1.3940364E-03 6.6789972E-04 3.3161316E-04 1.4011880E-04 4.1016330E-05 5 2.9050708E+05 8.0511924E-03 3.2058665E-03 1.5374411E-03 7.6417238E-04 3.2293773E-04 9.4540310E-05 6 1.0120331E+05 1.8259155E-02 7.3791538E-03 3.5536660E-03 1.7659028E-03 7.4634685E-04 2.1847720E-04 7 3.7393207E+04 4.1236765E-02 1.7078197E-02 8.2356942E-03 4.1010789E-03 1.7337497E-03 5.0760643E-04 8 1.4545231E+04 9.0497609E-02 3.8615881E-02 1.8785088E-02 9.3508601E-03 3.9540597E-03 1.1574983E-03 9 5.9219685E+03 1.8193037E-01 8.2908343E-02 4.0583585E-02 2.0303512E-02 8.5917694E-03 2.5160733E-03 10 2.5108681E+03 3.0019195E-01 1.5247527E-01 7.6762607E-02 3.8464967E-02 1.6294379E-02 4.7707100E-03 11 1.1046228E+03 3.2333450E-01 2.0079302E-01 1.0355371E-01 5.2724045E-02 2.2392344E-02 6.5634720E-03 12 5.0348250E+02 1.5282851E-01 2.6405532E-02 7.4548749E-03 2.0262532E-03 7.2043889E-04 1.9657771E-04 13 2.2300069E+02 1.4243638E-02 -4.7637205E-01 -4.0560587E-01 -2.2936321E-01 -1.0005351E-01 -2.9418210E-02 14 1.0444928E+02 -2.3231784E-04 -5.5960754E-01 -6.1104221E-01 -3.8606117E-01 -1.7293432E-01 -5.1141458E-02 15 4.3481712E+01 -8.8474742E-05 -1.0954733E-01 4.1466176E-01 4.2230623E-01 2.1078542E-01 6.3491024E-02 16 2.2682356E+01 5.2676110E-05 1.7204645E-02 8.4559364E-01 1.0397894E+00 5.5188845E-01 1.6738114E-01 17 9.3324404E+00 -3.7241996E-05 -6.3949465E-03 1.3321099E-01 -5.3629000E-01 -4.2794649E-01 -1.3712049E-01 18 4.7082932E+00 2.5096400E-05 3.1120463E-03 -1.6483234E-02 -9.2719903E-01 -9.3417046E-01 -3.2360937E-01 19 1.4803329E+00 -9.3267827E-06 -1.0494448E-03 4.5769518E-03 -7.1689941E-02 7.4444331E-01 3.6451519E-01 20 6.9266441E-01 4.3313766E-06 4.9492261E-04 -2.1340338E-03 1.5188106E-02 6.6383567E-01 4.1061114E-01 21 1.4246950E-01 -1.0670795E-06 -1.1845894E-04 4.8103396E-04 -2.8516844E-03 3.2767607E-02 -5.9323852E-01 22 5.1417865E-02 4.2581213E-07 4.7260276E-05 -1.8788054E-04 1.1270625E-03 -4.2956691E-03 -6.1006524E-01 2p 3p 4p 5p 1 6.1541358E+06 5.2731483E-05 2.6949748E-05 1.3258185E-05 5.1409386E-06 2 9.3548689E+05 1.7991172E-04 9.2033606E-05 4.5271051E-05 1.7561293E-05 3 1.9476704E+05 5.6169756E-04 2.8812070E-04 1.4192184E-04 5.5017534E-05 4 4.9096632E+04 1.7894119E-03 9.2233722E-04 4.5419175E-04 1.7637987E-04 5 1.4415854E+04 6.1581684E-03 3.2040270E-03 1.5847851E-03 6.1425527E-04 6 4.8367812E+03 2.1898456E-02 1.1534794E-02 5.7045236E-03 2.2195938E-03 7 1.8176265E+03 7.2054230E-02 3.8909153E-02 1.9429645E-02 7.5396542E-03 8 7.4754548E+02 1.9408552E-01 1.0911465E-01 5.4767894E-02 2.1403842E-02 9 3.2854050E+02 3.6612672E-01 2.1885868E-01 1.1240718E-01 4.3772483E-02 10 1.5142785E+02 3.7716589E-01 2.0038860E-01 9.6531621E-02 3.7883419E-02 11 7.0586341E+01 1.3925264E-01 -2.2714693E-01 -1.7869220E-01 -7.8001897E-02 12 3.4350220E+01 4.0868093E-03 -6.1992070E-01 -5.1642801E-01 -2.1952380E-01 13 1.6728933E+01 2.5833496E-03 -2.8213029E-01 1.1984928E-02 2.8170127E-02 14 7.8478932E+00 -1.4779397E-03 -1.8520285E-02 7.3780070E-01 4.7633806E-01 15 3.6808377E+00 6.5236553E-04 -1.6725321E-03 3.8008781E-01 1.6340971E-01 16 1.4887244E+00 -2.6097802E-04 5.3018847E-04 2.1481481E-02 -6.7330439E-01 17 5.9750705E-01 9.4460848E-05 -1.5808018E-04 5.9722350E-05 -5.0704337E-01 18 1.3059943E-01 -2.3090404E-05 4.6516203E-05 -8.4821125E-06 -3.8520775E-02 19 3.9996623E-02 8.5104931E-06 -1.6938465E-05 3.5584727E-06 7.4314573E-03 3d 4d 5d 1 4.2102882E+03 1.1184008E-03 5.7117778E-04 1.6051002E-04 2 1.1379254E+03 9.6082432E-03 4.9430330E-03 1.3771599E-03 3 4.1492475E+02 5.0583391E-02 2.6339410E-02 7.4242092E-03 4 1.7431919E+02 1.7307308E-01 9.2068057E-02 2.5779900E-02 5 7.9313985E+01 3.6485734E-01 1.9343291E-01 5.4905807E-02 6 3.7698494E+01 4.1388128E-01 1.7639224E-01 4.5685272E-02 7 1.8068275E+01 1.8213592E-01 -1.8969320E-01 -6.8752384E-02 8 8.5082552E+00 1.8784294E-02 -5.4526673E-01 -1.9394246E-01 9 3.8794137E+00 1.3183610E-03 -3.7386777E-01 -6.0686087E-02 10 1.5055675E+00 -1.9458640E-04 -5.3744504E-02 3.6141503E-01 11 5.7171607E-01 9.6389537E-05 2.8273354E-03 5.3189003E-01 12 1.8858452E-01 -3.6763042E-05 -1.2682747E-03 3.2641355E-01 4f 1 3.5243167E+02 2.9577331E-03 2 1.1968147E+02 2.3947052E-02 3 4.9829894E+01 9.7280377E-02 4 2.2610022E+01 2.4209284E-01 5 1.0557352E+01 3.6865247E-01 6 4.8641964E+00 3.6300769E-01 7 2.1311820E+00 2.0794523E-01 8 8.1914535E-01 4.8335223E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0217253E+07 6.9995736E-06 2.6885912E-06 1.2818921E-06 6.3629559E-07 2.6880980E-07 7.8690525E-08 2 1.0978438E+07 5.3673739E-05 2.0590245E-05 9.8315017E-06 4.8762795E-06 2.0599608E-06 6.0297190E-07 3 2.9762744E+06 2.3677630E-04 9.1063994E-05 4.3418337E-05 2.1554753E-05 9.1061715E-06 2.6657468E-06 4 8.9166997E+05 9.1530276E-04 3.5175361E-04 1.6806943E-04 8.3352401E-05 3.5212234E-05 1.0306811E-05 5 2.9050708E+05 3.1471935E-03 1.2158194E-03 5.7988836E-04 2.8798693E-04 1.2167101E-04 3.5619084E-05 6 1.0120331E+05 9.9457129E-03 3.8524625E-03 1.8441796E-03 9.1470753E-04 3.8644613E-04 1.1311328E-04 7 3.7393207E+04 2.8720853E-02 1.1302752E-02 5.4050185E-03 2.6871280E-03 1.1355033E-03 3.3243859E-04 8 1.4545231E+04 7.5011566E-02 3.0184800E-02 1.4560815E-02 7.2314715E-03 3.0563261E-03 8.9460665E-04 9 5.9219685E+03 1.6913418E-01 7.2516034E-02 3.5171818E-02 1.7561951E-02 7.4280142E-03 2.1751412E-03 10 2.5108681E+03 2.9984266E-01 1.4336397E-01 7.1603389E-02 3.5807252E-02 1.5161621E-02 4.4386798E-03 11 1.1046228E+03 3.3655580E-01 1.9802070E-01 1.0155075E-01 5.1642749E-02 2.1926866E-02 6.4267837E-03 12 5.0348250E+02 1.6252017E-01 3.1531553E-02 1.1342765E-02 4.1776975E-03 1.6528371E-03 4.7064244E-04 13 2.2300069E+02 1.5260111E-02 -4.7372439E-01 -3.9908319E-01 -2.2513526E-01 -9.8157152E-02 -2.8857820E-02 14 1.0444928E+02 -2.3635907E-04 -5.6430486E-01 -6.1176414E-01 -3.8616167E-01 -1.7294192E-01 -5.1142183E-02 15 4.3481712E+01 -1.1469585E-04 -1.1054339E-01 4.1217221E-01 4.1878105E-01 2.0890835E-01 6.2922077E-02 16 2.2682356E+01 7.8809182E-05 1.7170182E-02 8.4769442E-01 1.0404906E+00 5.5214623E-01 1.6745300E-01 17 9.3324404E+00 -5.7348772E-05 -6.2794564E-03 1.3334203E-01 -5.3584868E-01 -4.2727945E-01 -1.3688665E-01 18 4.7082932E+00 3.9258657E-05 3.0085838E-03 -1.6374445E-02 -9.2763606E-01 -9.3427430E-01 -3.2363925E-01 19 1.4803329E+00 -1.7904931E-05 -9.7178247E-04 4.4930538E-03 -7.1769694E-02 7.4436787E-01 3.6444613E-01 20 6.9266441E-01 1.0246052E-05 4.3665996E-04 -2.0717504E-03 1.5223032E-02 6.6392957E-01 4.1063801E-01 21 1.4246950E-01 -4.0684512E-06 -8.6033921E-05 4.4666784E-04 -2.8666208E-03 3.2753672E-02 -5.9324226E-01 22 5.1417865E-02 2.5111022E-06 2.3963025E-05 -1.6325796E-04 1.1369555E-03 -4.2848504E-03 -6.1006405E-01 2p 3p 4p 5p 1 6.1541358E+06 1.0203211E-06 5.2283030E-07 2.5780184E-07 9.9798973E-08 2 9.3548689E+05 1.0870041E-05 5.5769186E-06 2.7393127E-06 1.0651427E-06 3 1.9476704E+05 8.6446930E-05 4.4553741E-05 2.2013811E-05 8.5178716E-06 4 4.9096632E+04 5.9401237E-04 3.0685591E-04 1.5095497E-04 5.8719234E-05 5 1.4415854E+04 3.4699150E-03 1.8044631E-03 8.9317991E-04 3.4586133E-04 6 4.8367812E+03 1.6661362E-02 8.7431605E-03 4.3180426E-03 1.6806112E-03 7 1.8176265E+03 6.3662749E-02 3.4207795E-02 1.7066396E-02 6.6193524E-03 8 7.4754548E+02 1.8404631E-01 1.0297311E-01 5.1622245E-02 2.0172329E-02 9 3.2854050E+02 3.5870023E-01 2.1369441E-01 1.0968810E-01 4.2704674E-02 10 1.5142785E+02 3.7421479E-01 1.9914299E-01 9.6080917E-02 3.7721737E-02 11 7.0586341E+01 1.3668925E-01 -2.2595269E-01 -1.7722487E-01 -7.7331605E-02 12 3.4350220E+01 1.2478082E-03 -6.2030397E-01 -5.1594808E-01 -2.1927664E-01 13 1.6728933E+01 -7.1788784E-05 -2.8283301E-01 1.1100037E-02 2.7685609E-02 14 7.8478932E+00 -3.5667540E-03 -1.8627029E-02 7.3747206E-01 4.7603426E-01 15 3.6808377E+00 -1.4122637E-03 -1.7655266E-03 3.7990666E-01 1.6339486E-01 16 1.4887244E+00 -1.8810249E-03 4.7320862E-04 2.1222780E-02 -6.7333243E-01 17 5.9750705E-01 -1.7028388E-03 -2.3151406E-04 -2.3750064E-04 -5.0712172E-01 18 1.3059943E-01 -1.6827375E-03 -1.6935522E-05 -2.8316608E-04 -3.8567780E-02 19 3.9996623E-02 -9.4097737E-04 -5.4983162E-05 -1.5342392E-04 7.4035699E-03 3d 4d 5d 1 4.2102882E+03 7.9817713E-04 4.0737893E-04 1.1466538E-04 2 1.1379254E+03 8.5722606E-03 4.4057934E-03 1.2266753E-03 3 4.1492475E+02 4.8319253E-02 2.5134373E-02 7.0846049E-03 4 1.7431919E+02 1.6992549E-01 9.0322323E-02 2.5285974E-02 5 7.9313985E+01 3.6226049E-01 1.9198253E-01 5.4493249E-02 6 3.7698494E+01 4.1289000E-01 1.7610926E-01 4.5628642E-02 7 1.8068275E+01 1.8176796E-01 -1.8922149E-01 -6.8569769E-02 8 8.5082552E+00 1.8447420E-02 -5.4501791E-01 -1.9383153E-01 9 3.8794137E+00 1.0937806E-03 -3.7382114E-01 -6.0708070E-02 10 1.5055675E+00 -3.3031347E-04 -5.3691162E-02 3.6136435E-01 11 5.7171607E-01 3.8394874E-05 2.8594028E-03 5.3187460E-01 12 1.8858452E-01 -7.7429483E-05 -1.2482981E-03 3.2640445E-01 4f 1 3.5243167E+02 2.8043780E-03 2 1.1968147E+02 2.3535883E-02 3 4.9829894E+01 9.6606357E-02 4 2.2610022E+01 2.4144025E-01 5 1.0557352E+01 3.6824477E-01 6 4.8641964E+00 3.6284750E-01 7 2.1311820E+00 2.0789430E-01 8 8.1914535E-01 4.8316830E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 5.0217253E+07 6.0768701E-04 -2.3761653E-04 1.1363205E-04 5.6391848E-05 -2.3827501E-05 -6.9764770E-06 2 1.0978438E+07 1.5245840E-03 -5.9747765E-04 2.8571657E-04 1.4201141E-04 -5.9981085E-05 -1.7555574E-05 3 2.9762744E+06 3.2586651E-03 -1.2799566E-03 6.1254459E-04 3.0388839E-04 -1.2842938E-04 -3.7607797E-05 4 8.9166997E+05 6.5680915E-03 -2.5952403E-03 1.2428641E-03 6.1809455E-04 -2.6105596E-04 -7.6399986E-05 5 2.9050708E+05 1.3020812E-02 -5.1898973E-03 2.4894941E-03 1.2355584E-03 -5.2233086E-04 -1.5296984E-04 6 1.0120331E+05 2.5859367E-02 -1.0447205E-02 5.0272419E-03 2.5015135E-03 -1.0566157E-03 -3.0918192E-04 7 3.7393207E+04 5.2047360E-02 -2.1499272E-02 1.0371980E-02 5.1577031E-03 -2.1813266E-03 -6.3886645E-04 8 1.4545231E+04 1.0459118E-01 -4.4590061E-02 2.1700514E-02 1.0817950E-02 -4.5747029E-03 -1.3390680E-03 9 5.9219685E+03 1.9805907E-01 -9.0349751E-02 4.4257425E-02 2.2112842E-02 -9.3562213E-03 -2.7397752E-03 10 2.5108681E+03 3.1344416E-01 -1.6008564E-01 8.0740757E-02 4.0499768E-02 -1.7153747E-02 -5.0216582E-03 11 1.1046228E+03 3.2659184E-01 -2.0540071E-01 1.0632244E-01 5.4174303E-02 -2.3031606E-02 -6.7537468E-03 12 5.0348250E+02 1.4908214E-01 -2.3206541E-02 5.9738484E-03 1.3027899E-03 -4.0599122E-04 -1.0235515E-04 13 2.2300069E+02 1.2774420E-02 4.8213250E-01 -4.1076980E-01 -2.3244113E-01 1.0142478E-01 2.9823585E-02 14 1.0444928E+02 -5.4208639E-04 5.5966169E-01 -6.1199270E-01 -3.8687535E-01 1.7330861E-01 5.1251759E-02 15 4.3481712E+01 -8.6452497E-05 1.0857927E-01 4.1736710E-01 4.2456148E-01 -2.1187768E-01 -6.3819785E-02 16 2.2682356E+01 8.9117806E-06 -1.7349757E-02 8.4575406E-01 1.0402948E+00 -5.5221489E-01 -1.6748132E-01 17 9.3324404E+00 -3.4741214E-05 6.4557936E-03 1.3281102E-01 -5.3725470E-01 4.2858598E-01 1.3732393E-01 18 4.7082932E+00 1.4299840E-05 -3.1410840E-03 -1.6475664E-02 -9.2711953E-01 9.3416476E-01 3.2361352E-01 19 1.4803329E+00 -5.7988188E-06 1.0466524E-03 4.5916797E-03 -7.1621230E-02 -7.4458592E-01 -3.6457670E-01 20 6.9266441E-01 2.4886203E-06 -4.9449730E-04 -2.1435847E-03 1.5182352E-02 -6.6380782E-01 -4.1060053E-01 21 1.4246950E-01 -9.4368616E-07 1.1883071E-04 4.8054074E-04 -2.8553221E-03 -3.2762450E-02 5.9324539E-01 22 5.1417865E-02 3.3587719E-07 -4.7665962E-05 -1.8735761E-04 1.1289596E-03 4.2950754E-03 6.1006403E-01 2p 3p 4p 5p 1 6.1541358E+06 5.1067227E-05 -2.5913090E-05 1.2770864E-05 -4.9418186E-06 2 9.3548689E+05 1.8453486E-04 -9.3859029E-05 4.5985661E-05 -1.7871828E-05 3 1.9476704E+05 6.1460222E-04 -3.1429681E-04 1.5523555E-04 -6.0062880E-05 4 4.9096632E+04 2.0111671E-03 -1.0349719E-03 5.0850198E-04 -1.9773788E-04 5 1.4415854E+04 6.8067324E-03 -3.5382585E-03 1.7524885E-03 -6.7866685E-04 6 4.8367812E+03 2.3406763E-02 -1.2322287E-02 6.0897281E-03 -2.3706841E-03 7 1.8176265E+03 7.5001674E-02 -4.0502908E-02 2.0233832E-02 -7.8495748E-03 8 7.4754548E+02 1.9842318E-01 -1.1162976E-01 5.6033067E-02 -2.1902741E-02 9 3.2854050E+02 3.6985180E-01 -2.2141669E-01 1.1379172E-01 -4.4311977E-02 10 1.5142785E+02 3.7789246E-01 -2.0087527E-01 9.6775532E-02 -3.7990706E-02 11 7.0586341E+01 1.3863467E-01 2.2873607E-01 -1.7975286E-01 7.8459195E-02 12 3.4350220E+01 3.9567812E-03 6.2070820E-01 -5.1726104E-01 2.1988635E-01 13 1.6728933E+01 2.5716482E-03 2.8185803E-01 1.2509436E-02 -2.8411287E-02 14 7.8478932E+00 -1.4773713E-03 1.8482400E-02 7.3805501E-01 -4.7653606E-01 15 3.6808377E+00 6.5044178E-04 1.6575924E-03 3.8003539E-01 -1.6334904E-01 16 1.4887244E+00 -2.6048541E-04 -5.2583072E-04 2.1465780E-02 6.7335933E-01 17 5.9750705E-01 9.4188030E-05 1.5646062E-04 5.9320261E-05 5.0703728E-01 18 1.3059943E-01 -2.3014251E-05 -4.6232432E-05 -8.2997398E-06 3.8519316E-02 19 3.9996623E-02 8.4808505E-06 1.6828414E-05 3.5163584E-06 -7.4315196E-03 3d 4d 5d 1 4.2102882E+03 1.1938949E-03 -6.0917549E-04 1.7138051E-04 2 1.1379254E+03 9.9068096E-03 -5.0962337E-03 1.4193003E-03 3 4.1492475E+02 5.1384801E-02 -2.6756282E-02 7.5426934E-03 4 1.7431919E+02 1.7444562E-01 -9.2815491E-02 2.5988531E-02 5 7.9313985E+01 3.6614527E-01 -1.9415488E-01 5.5115614E-02 6 3.7698494E+01 4.1431341E-01 -1.7656256E-01 4.5723460E-02 7 1.8068275E+01 1.8204474E-01 1.9005250E-01 -6.8867598E-02 8 8.5082552E+00 1.8758272E-02 5.4546579E-01 -1.9402215E-01 9 3.8794137E+00 1.3150866E-03 3.7386672E-01 -6.0668479E-02 10 1.5055675E+00 -1.9385921E-04 5.3733485E-02 3.6144716E-01 11 5.7171607E-01 9.6086740E-05 -2.8272968E-03 5.3189770E-01 12 1.8858452E-01 -3.6694710E-05 1.2682539E-03 3.2641366E-01 4f 1 3.5243167E+02 3.0022561E-03 2 1.1968147E+02 2.4101113E-02 3 4.9829894E+01 9.7563794E-02 4 2.2610022E+01 2.4240557E-01 5 1.0557352E+01 3.6883672E-01 6 4.8641964E+00 3.6306953E-01 7 2.1311820E+00 2.0795050E-01 8 8.1914535E-01 4.8334087E-02 ** Pt ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0554041E+07 2.4311217E-04 9.4038518E-05 4.4960518E-05 2.2386831E-05 9.5648333E-06 2.8075035E-06 2 1.1143707E+07 6.6936434E-04 2.5998728E-04 1.2443561E-04 6.1958167E-05 2.6472873E-05 7.7703088E-06 3 3.0420913E+06 1.6105880E-03 6.2984714E-04 3.0161116E-04 1.5025489E-04 6.4203267E-05 1.8845646E-05 4 9.1604274E+05 3.6574717E-03 1.4429933E-03 6.9255914E-04 3.4500507E-04 1.4743188E-04 4.3274658E-05 5 2.9956850E+05 8.2292533E-03 3.2928209E-03 1.5819941E-03 7.8893143E-04 3.3717711E-04 9.8977067E-05 6 1.0462814E+05 1.8515120E-02 7.5209311E-03 3.6284213E-03 1.8091266E-03 7.7330754E-04 2.2698767E-04 7 3.8723387E+04 4.1505493E-02 1.7280087E-02 8.3489338E-03 4.1713370E-03 1.7834135E-03 5.2356412E-04 8 1.5077101E+04 9.0522288E-02 3.8829858E-02 1.8923377E-02 9.4517674E-03 4.0422903E-03 1.1865716E-03 9 6.1411452E+03 1.8120355E-01 8.2950348E-02 4.0680232E-02 2.0419306E-02 8.7383921E-03 2.5659437E-03 10 2.6039146E+03 2.9858844E-01 1.5203444E-01 7.6647293E-02 3.8536971E-02 1.6511913E-02 4.8477798E-03 11 1.1453476E+03 3.2262163E-01 1.9985929E-01 1.0316702E-01 5.2685040E-02 2.2625109E-02 6.6494396E-03 12 5.2197130E+02 1.5412152E-01 2.6640245E-02 7.2640373E-03 1.9115153E-03 6.8421776E-04 1.8696529E-04 13 2.3112078E+02 1.4761767E-02 -4.7407763E-01 -4.0431704E-01 -2.2956970E-01 -1.0135391E-01 -2.9890501E-02 14 1.0825551E+02 -2.9109030E-04 -5.6005441E-01 -6.1178124E-01 -3.8775389E-01 -1.7569680E-01 -5.2109779E-02 15 4.5166553E+01 -5.5100204E-05 -1.1076112E-01 4.0934702E-01 4.1961961E-01 2.1207422E-01 6.4095913E-02 16 2.3576687E+01 3.2461466E-05 1.7290987E-02 8.4815422E-01 1.0463620E+00 5.6331617E-01 1.7158582E-01 17 9.7353224E+00 -2.7875426E-05 -6.5022721E-03 1.3575674E-01 -5.2611059E-01 -4.2870907E-01 -1.3834583E-01 18 4.9359837E+00 2.0548425E-05 3.1841016E-03 -1.6843590E-02 -9.3651275E-01 -9.5743698E-01 -3.3378481E-01 19 1.5726304E+00 -7.7164429E-06 -1.0726215E-03 4.6465709E-03 -7.3473076E-02 7.5333134E-01 3.7563532E-01 20 7.3587053E-01 3.5109118E-06 4.9989522E-04 -2.1423615E-03 1.5142809E-02 6.6640856E-01 4.0536591E-01 21 1.5177204E-01 -8.6026313E-07 -1.1808280E-04 4.7570014E-04 -2.8100149E-03 3.2589489E-02 -5.8999966E-01 22 5.4134642E-02 3.3996310E-07 4.6614294E-05 -1.8350000E-04 1.1004205E-03 -4.1678975E-03 -6.1308104E-01 2p 3p 4p 5p 1 6.6448052E+06 5.2382665E-05 2.6836377E-05 1.3259325E-05 5.2163794E-06 2 1.0175399E+06 1.7814970E-04 9.1356183E-05 4.5129868E-05 1.7761654E-05 3 2.1240039E+05 5.5207925E-04 2.8382898E-04 1.4041227E-04 5.5227616E-05 4 5.3523591E+04 1.7379854E-03 8.9797670E-04 4.4404697E-04 1.7494683E-04 5 1.5669397E+04 5.9051205E-03 3.0783438E-03 1.5292913E-03 6.0142500E-04 6 5.2326705E+03 2.0850461E-02 1.1007579E-02 5.4657973E-03 2.1576042E-03 7 1.9565976E+03 6.8725128E-02 3.7147266E-02 1.8629669E-02 7.3350319E-03 8 8.0119731E+02 1.8697780E-01 1.0519165E-01 5.2987728E-02 2.1007429E-02 9 3.5091728E+02 3.5981161E-01 2.1484126E-01 1.1079392E-01 4.3780914E-02 10 1.6136672E+02 3.8318544E-01 2.0899630E-01 1.0198370E-01 4.0635480E-02 11 7.5381526E+01 1.4955456E-01 -2.0168025E-01 -1.6123944E-01 -7.1721099E-02 12 3.6636306E+01 6.1125289E-03 -6.1785534E-01 -5.1767413E-01 -2.2375258E-01 13 1.7921896E+01 2.4688490E-03 -3.0255129E-01 -2.5313615E-02 9.9023513E-03 14 8.3625105E+00 -1.4200133E-03 -2.3278821E-02 7.3391194E-01 4.8253475E-01 15 3.9334461E+00 6.2866522E-04 -1.1169104E-03 4.0034859E-01 1.8453723E-01 16 1.5882407E+00 -2.5068152E-04 3.4402491E-04 2.4047021E-02 -6.7916588E-01 17 6.3724541E-01 9.1088263E-05 -8.9088775E-05 -1.2519996E-04 -5.0964042E-01 18 1.3801485E-01 -2.1851957E-05 3.0385453E-05 4.0664574E-05 -3.7762286E-02 19 4.1618396E-02 7.9941158E-06 -1.0891182E-05 -1.3416951E-05 7.2927189E-03 3d 4d 5d 1 4.4038294E+03 1.1028373E-03 5.6732009E-04 1.6530096E-04 2 1.1869536E+03 9.4527498E-03 4.8992454E-03 1.4153351E-03 3 4.3209912E+02 4.9873678E-02 2.6157816E-02 7.6454958E-03 4 1.8137709E+02 1.7134958E-01 9.1828331E-02 2.6665388E-02 5 8.2508034E+01 3.6323168E-01 1.9406545E-01 5.7129393E-02 6 3.9230916E+01 4.1479313E-01 1.7896909E-01 4.8083867E-02 7 1.8825208E+01 1.8445559E-01 -1.8727666E-01 -7.1009191E-02 8 8.8841282E+00 1.9386866E-02 -5.4596287E-01 -2.0262888E-01 9 4.0759000E+00 1.3101929E-03 -3.7370168E-01 -6.2194265E-02 10 1.6023488E+00 -2.0339756E-04 -5.3729252E-02 3.7290898E-01 11 6.1433546E-01 9.5934685E-05 2.5927726E-03 5.3130171E-01 12 2.0453950E-01 -3.7868050E-05 -1.2357612E-03 3.1316908E-01 4f 1 3.7607630E+02 2.8048489E-03 2 1.2770223E+02 2.2930750E-02 3 5.3273822E+01 9.4319379E-02 4 2.4233222E+01 2.3816056E-01 5 1.1367661E+01 3.6794900E-01 6 5.2739356E+00 3.6550053E-01 7 2.3330345E+00 2.0810097E-01 8 9.0639763E-01 4.7338145E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0554041E+07 7.2423977E-06 2.7947324E-06 1.3348150E-06 6.6475544E-07 2.8401115E-07 8.3366162E-08 2 1.1143707E+07 5.5185799E-05 2.1268587E-05 1.0172634E-05 5.0622828E-06 2.1628118E-06 6.3480292E-07 3 3.0420913E+06 2.4130992E-04 9.3238397E-05 4.4532687E-05 2.2181012E-05 9.4767564E-06 2.7817576E-06 4 9.1604274E+05 9.2639501E-04 3.5767836E-04 1.7118988E-04 8.5183328E-05 3.6394483E-05 1.0681924E-05 5 2.9956850E+05 3.1662491E-03 1.2288670E-03 5.8714341E-04 2.9255222E-04 1.2499713E-04 3.6691972E-05 6 1.0462814E+05 9.9588959E-03 3.8754490E-03 1.8583070E-03 9.2479922E-04 3.9515237E-04 1.1597761E-04 7 3.8723387E+04 2.8650912E-02 1.1325626E-02 5.4255062E-03 2.7061905E-03 1.1564743E-03 3.3949471E-04 8 1.5077101E+04 7.4628806E-02 3.0154263E-02 1.4569555E-02 7.2600710E-03 3.1033653E-03 9.1086422E-04 9 6.1411452E+03 1.6803730E-01 7.2268954E-02 3.5109718E-02 1.7587972E-02 7.5228730E-03 2.2088716E-03 10 2.6039146E+03 2.9812287E-01 1.4266999E-01 7.1340243E-02 3.5794131E-02 1.5329495E-02 4.5002301E-03 11 1.1453476E+03 3.3613662E-01 1.9699637E-01 1.0110359E-01 5.1568179E-02 2.2138934E-02 6.5062832E-03 12 5.2197130E+02 1.6418250E-01 3.1905028E-02 1.1267638E-02 4.1357156E-03 1.6593420E-03 4.7440026E-04 13 2.3112078E+02 1.5849669E-02 -4.7131626E-01 -3.9757487E-01 -2.2518415E-01 -9.9363105E-02 -2.9300377E-02 14 1.0825551E+02 -2.9941999E-04 -5.6489479E-01 -6.1250544E-01 -3.8784233E-01 -1.7569742E-01 -5.2108345E-02 15 4.5166553E+01 -8.0191972E-05 -1.1180506E-01 4.0675543E-01 4.1595107E-01 2.1009594E-01 6.3494064E-02 16 2.3576687E+01 5.8558531E-05 1.7255107E-02 8.5032490E-01 1.0470763E+00 5.6357607E-01 1.7165780E-01 17 9.7353224E+00 -4.8631949E-05 -6.3814520E-03 1.3590029E-01 -5.2563502E-01 -4.2799100E-01 -1.3809219E-01 18 4.9359837E+00 3.5419949E-05 3.0752564E-03 -1.6731237E-02 -9.3697380E-01 -9.5754990E-01 -3.3381782E-01 19 1.5726304E+00 -1.6789805E-05 -9.9141132E-04 4.5600862E-03 -7.3558473E-02 7.5325088E-01 3.7556039E-01 20 7.3587053E-01 9.7380533E-06 4.3954266E-04 -2.0787427E-03 1.5179471E-02 6.6650917E-01 4.0539525E-01 21 1.5177204E-01 -4.0011250E-06 -8.4906048E-05 4.4101122E-04 -2.8254883E-03 3.2574792E-02 -5.9000380E-01 22 5.4134642E-02 2.5171616E-06 2.2883226E-05 -1.5875409E-04 1.1106152E-03 -4.1565340E-03 -6.1307963E-01 2p 3p 4p 5p 1 6.6448052E+06 9.8126144E-07 5.0388336E-07 2.4957623E-07 9.8028512E-08 2 1.0175399E+06 1.0318111E-05 5.3084900E-06 2.6179798E-06 1.0327499E-06 3 2.1240039E+05 8.1090151E-05 4.1877467E-05 2.0786753E-05 8.1608400E-06 4 5.3523591E+04 5.5305504E-04 2.8651158E-04 1.4151309E-04 5.5847868E-05 5 1.5669397E+04 3.2309122E-03 1.6835887E-03 8.3716587E-04 3.2891434E-04 6 5.2326705E+03 1.5604310E-02 8.2082065E-03 4.0699456E-03 1.6070902E-03 7 1.9565976E+03 6.0228121E-02 3.2390127E-02 1.6229428E-02 6.3867471E-03 8 8.0119731E+02 1.7663989E-01 9.8884392E-02 4.9746704E-02 1.9720247E-02 9 3.5091728E+02 3.5194880E-01 2.0939483E-01 1.0791547E-01 4.2633846E-02 10 1.6136672E+02 3.8002102E-01 2.0752399E-01 1.0139867E-01 4.0416844E-02 11 7.5381526E+01 1.4697304E-01 -2.0044732E-01 -1.5974393E-01 -7.1028340E-02 12 3.6636306E+01 3.1822990E-03 -6.1815915E-01 -5.1707411E-01 -2.2344274E-01 13 1.7921896E+01 -2.7411919E-04 -3.0331389E-01 -2.6229686E-02 9.3971410E-03 14 8.3625105E+00 -3.6123671E-03 -2.3395870E-02 7.3354061E-01 4.8219188E-01 15 3.9334461E+00 -1.4950935E-03 -1.2121462E-03 4.0017115E-01 1.8452470E-01 16 1.5882407E+00 -1.9450001E-03 2.8727088E-04 2.3775894E-02 -6.7919516E-01 17 6.3724541E-01 -1.7719201E-03 -1.6429641E-04 -4.3543465E-04 -5.0972270E-01 18 1.3801485E-01 -1.7615103E-03 -3.4080149E-05 -2.4917076E-04 -3.7811618E-02 19 4.1618396E-02 -9.7301266E-04 -4.9584178E-05 -1.7669792E-04 7.2639407E-03 3d 4d 5d 1 4.4038294E+03 7.7832882E-04 4.0012291E-04 1.1677978E-04 2 1.1869536E+03 8.3968016E-03 4.3476806E-03 1.2551341E-03 3 4.3209912E+02 4.7555245E-02 2.4915056E-02 7.2822965E-03 4 1.8137709E+02 1.6810508E-01 9.0015814E-02 2.6133491E-02 5 8.2508034E+01 3.6053733E-01 1.9254840E-01 5.6681756E-02 6 3.9230916E+01 4.1375716E-01 1.7866562E-01 4.8020494E-02 7 1.8825208E+01 1.8407628E-01 -1.8678407E-01 -7.0810016E-02 8 8.8841282E+00 1.9038203E-02 -5.4570134E-01 -2.0250693E-01 9 4.0759000E+00 1.0782834E-03 -3.7365493E-01 -6.2219907E-02 10 1.6023488E+00 -3.4497612E-04 -5.3673539E-02 3.7285364E-01 11 6.1433546E-01 3.4683741E-05 2.6268676E-03 5.3128535E-01 12 2.0453950E-01 -8.1121209E-05 -1.2143619E-03 3.1315917E-01 4f 1 3.7607630E+02 2.6506380E-03 2 1.2770223E+02 2.2510182E-02 3 5.3273822E+01 9.3618231E-02 4 2.4233222E+01 2.3746760E-01 5 1.1367661E+01 3.6750942E-01 6 5.2739356E+00 3.6532657E-01 7 2.3330345E+00 2.0804644E-01 8 9.0639763E-01 4.7317499E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 5.0554041E+07 6.3924967E-04 -2.5112759E-04 1.2030179E-04 5.9900233E-05 -2.5596726E-05 -7.5150332E-06 2 1.1143707E+07 1.5937637E-03 -6.2752137E-04 3.0059787E-04 1.4990265E-04 -6.4032299E-05 -1.8791629E-05 3 3.0420913E+06 3.3852697E-03 -1.3359307E-03 6.4045466E-04 3.1879042E-04 -1.3625379E-04 -4.0009284E-05 4 9.1604274E+05 6.7809276E-03 -2.6920990E-03 1.2914477E-03 6.4439363E-04 -2.7525146E-04 -8.0769425E-05 5 2.9956850E+05 1.3357361E-02 -5.3497699E-03 2.5707516E-03 1.2801238E-03 -5.4730224E-04 -1.6072824E-04 6 1.0462814E+05 2.6341888E-02 -1.0695971E-02 5.1557808E-03 2.5741099E-03 -1.0996253E-03 -3.2262660E-04 7 3.8723387E+04 5.2619507E-02 -2.1848812E-02 1.0560364E-02 5.2687863E-03 -2.2535370E-03 -6.6183921E-04 8 1.5077101E+04 1.0498029E-01 -4.4991484E-02 2.1934866E-02 1.0972264E-02 -4.6928437E-03 -1.3773665E-03 9 6.1411452E+03 1.9771908E-01 -9.0602750E-02 4.4464950E-02 2.2289421E-02 -9.5375131E-03 -2.8005319E-03 10 2.6039146E+03 3.1219803E-01 -1.5984872E-01 8.0735825E-02 4.0635308E-02 -1.7408076E-02 -5.1099894E-03 11 1.1453476E+03 3.2608057E-01 -2.0460217E-01 1.0601615E-01 5.4181111E-02 -2.3292061E-02 -6.8487371E-03 12 5.2197130E+02 1.5032674E-01 -2.3388236E-02 5.7500565E-03 1.1694529E-03 -3.5828514E-04 -8.8935978E-05 13 2.3112078E+02 1.3227208E-02 4.8001151E-01 -4.0963214E-01 -2.3275021E-01 1.0278844E-01 3.0315909E-02 14 1.0825551E+02 -6.1145366E-04 5.6013866E-01 -6.1279309E-01 -3.8861454E-01 1.7609637E-01 5.2227884E-02 15 4.5166553E+01 -5.4528744E-05 1.0975400E-01 4.1214596E-01 4.2195675E-01 -2.1321938E-01 -6.4441712E-02 16 2.3576687E+01 -1.2241335E-05 -1.7440959E-02 8.4833486E-01 1.0469067E+00 -5.6367216E-01 -1.7169584E-01 17 9.7353224E+00 -2.5537166E-05 6.5643110E-03 1.3533832E-01 -5.2712021E-01 4.2938891E-01 1.3856356E-01 18 4.9359837E+00 9.4722628E-06 -3.2139338E-03 -1.6836379E-02 -9.3643441E-01 9.5743484E-01 3.3379045E-01 19 1.5726304E+00 -4.0996506E-06 1.0694405E-03 4.6623835E-03 -7.3398389E-02 -7.5348637E-01 -3.7570279E-01 20 7.3587053E-01 1.6355923E-06 -4.9931521E-04 -2.1526091E-03 1.5136006E-02 -6.6637809E-01 -4.0535378E-01 21 1.5177204E-01 -7.4559548E-07 1.1842856E-04 4.7525643E-04 -2.8135955E-03 -3.2584111E-02 5.9000680E-01 22 5.4134642E-02 2.5349655E-07 -4.7018620E-05 -1.8298087E-04 1.1023320E-03 4.1672918E-03 6.1307982E-01 2p 3p 4p 5p 1 6.6448052E+06 5.0581150E-05 -2.5723136E-05 1.2733576E-05 -4.9995482E-06 2 1.0175399E+06 1.8217096E-04 -9.2899439E-05 4.5702970E-05 -1.8019511E-05 3 2.1240039E+05 6.0285232E-04 -3.0892225E-04 1.5326600E-04 -6.0170348E-05 4 5.3523591E+04 1.9549665E-03 -1.0085865E-03 4.9754654E-04 -1.9628562E-04 5 1.5669397E+04 6.5470599E-03 -3.4098187E-03 1.6964953E-03 -6.6660914E-04 6 5.2326705E+03 2.2353159E-02 -1.1794621E-02 5.8521301E-03 -2.3112816E-03 7 1.9565976E+03 7.1681221E-02 -3.8746378E-02 1.9440499E-02 -7.6522191E-03 8 8.0119731E+02 1.9140075E-01 -1.0775387E-01 5.4280205E-02 -2.1524268E-02 9 3.5091728E+02 3.6374308E-01 -2.1751333E-01 1.1224272E-01 -4.4353639E-02 10 1.6136672E+02 3.8407309E-01 -2.0963337E-01 1.0231149E-01 -4.0778732E-02 11 7.5381526E+01 1.4890975E-01 2.0328958E-01 -1.6230249E-01 7.2185419E-02 12 3.6636306E+01 5.9648978E-03 6.1874651E-01 -5.1860663E-01 2.2416556E-01 13 1.7921896E+01 2.4532852E-03 3.0227653E-01 -2.4788499E-02 -1.0145941E-02 14 8.3625105E+00 -1.4184338E-03 2.3232009E-02 7.3420091E-01 -4.8275855E-01 15 3.9334461E+00 6.2629741E-04 1.1002642E-03 4.0029505E-01 -1.8447421E-01 16 1.5882407E+00 -2.5009470E-04 -3.3903739E-04 2.4028974E-02 6.7922654E-01 17 6.3724541E-01 9.0766477E-05 8.7260457E-05 -1.2551488E-04 5.0963360E-01 18 1.3801485E-01 -2.1761607E-05 -3.0074820E-05 4.0850929E-05 3.7760768E-02 19 4.1618396E-02 7.9592433E-06 1.0773139E-05 -1.3460930E-05 -7.2927917E-03 3d 4d 5d 1 4.4038294E+03 1.1795560E-03 -6.0621624E-04 1.7683827E-04 2 1.1869536E+03 9.7566134E-03 -5.0563461E-03 1.4601421E-03 3 4.3209912E+02 5.0692295E-02 -2.6586670E-02 7.7718913E-03 4 1.8137709E+02 1.7276066E-01 -9.2602413E-02 2.6889485E-02 5 8.2508034E+01 3.6456805E-01 -1.9482019E-01 5.7356886E-02 6 3.9230916E+01 4.1524869E-01 -1.7915277E-01 4.8126944E-02 7 1.8825208E+01 1.8436208E-01 1.8765078E-01 -7.1134119E-02 8 8.8841282E+00 1.9359138E-02 5.4617292E-01 -2.0271670E-01 9 4.0759000E+00 1.3066530E-03 3.7370033E-01 -6.2174359E-02 10 1.6023488E+00 -2.0260175E-04 5.3717410E-02 3.7294441E-01 11 6.1433546E-01 9.5603053E-05 -2.5927445E-03 5.3130963E-01 12 2.0453950E-01 -3.7793427E-05 1.2357377E-03 3.1316911E-01 4f 1 3.7607630E+02 2.8493805E-03 2 1.2770223E+02 2.3087134E-02 3 5.3273822E+01 9.4612854E-02 4 2.4233222E+01 2.3849186E-01 5 1.1367661E+01 3.6814921E-01 6 5.2739356E+00 3.6556858E-01 7 2.3330345E+00 2.0810641E-01 8 9.0639763E-01 4.7336818E-02 ** Au ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0874159E+07 2.5605324E-04 9.9509270E-05 4.7656339E-05 2.3807125E-05 1.0279113E-05 3.0211410E-06 2 1.1304982E+07 7.0013088E-04 2.7322583E-04 1.3099202E-04 6.5437643E-05 2.8255188E-05 8.3044287E-06 3 3.1073467E+06 1.6724853E-03 6.5716600E-04 3.1523080E-04 1.5755639E-04 6.8034269E-05 1.9996483E-05 4 9.4045868E+05 3.7690840E-03 1.4942255E-03 7.1836713E-04 3.5904548E-04 1.5505550E-04 4.5572762E-05 5 3.0871304E+05 8.4145860E-03 3.3836044E-03 1.6284757E-03 8.1478788E-04 3.5190495E-04 1.0343628E-04 6 1.0810191E+05 1.8782854E-02 7.6690534E-03 3.7063492E-03 1.8541480E-03 8.0095395E-04 2.3541645E-04 7 4.0077299E+04 4.1793882E-02 1.7492464E-02 8.4672751E-03 4.2444575E-03 1.8338259E-03 5.3906980E-04 8 1.5619671E+04 9.0579921E-02 3.9061022E-02 1.9069767E-02 9.5569845E-03 4.1307483E-03 1.2141721E-03 9 6.3650098E+03 1.8052458E-01 8.3017695E-02 4.0787744E-02 2.0540599E-02 8.8828674E-03 2.6117637E-03 10 2.6989909E+03 2.9701553E-01 1.5161872E-01 7.6541560E-02 3.8612319E-02 1.6721054E-02 4.9159540E-03 11 1.1869469E+03 3.2185024E-01 1.9889606E-01 1.0275640E-01 5.2631974E-02 2.2836705E-02 6.7200155E-03 12 5.4083495E+02 1.5531848E-01 2.6706353E-02 6.9693376E-03 1.7373814E-03 6.2048173E-04 1.6936386E-04 13 2.3943008E+02 1.5265724E-02 -4.7189132E-01 -4.0312850E-01 -2.2982018E-01 -1.0261319E-01 -3.0311750E-02 14 1.1215195E+02 -3.4543451E-04 -5.6034732E-01 -6.1229585E-01 -3.8931130E-01 -1.7830017E-01 -5.2958843E-02 15 4.6894425E+01 -2.3623304E-05 -1.1191281E-01 4.0431403E-01 4.1719338E-01 2.1332381E-01 6.4592031E-02 16 2.4493222E+01 1.3298692E-05 1.7362233E-02 8.5050205E-01 1.0526682E+00 5.7437572E-01 1.7547320E-01 17 1.0148220E+01 -1.8833788E-05 -6.6034900E-03 1.3821084E-01 -5.1656637E-01 -4.2967435E-01 -1.3949058E-01 18 5.1705371E+00 1.6090646E-05 3.2530543E-03 -1.7200704E-02 -9.4530743E-01 -9.7955383E-01 -3.4301129E-01 19 1.6681143E+00 -6.1340645E-06 -1.0934579E-03 4.7091816E-03 -7.5152531E-02 7.6186161E-01 3.8552700E-01 20 7.8012050E-01 2.7199340E-06 5.0327101E-04 -2.1457583E-03 1.5055061E-02 6.6898565E-01 4.0013424E-01 21 1.6103441E-01 -6.6571699E-07 -1.1736827E-04 4.6949863E-04 -2.7638970E-03 3.2348479E-02 -5.8700695E-01 22 5.6807117E-02 2.6109472E-07 4.5913516E-05 -1.7915675E-04 1.0739631E-03 -4.0638512E-03 -6.1554416E-01 2p 3p 4p 5p 1 7.1559085E+06 5.2095909E-05 2.6753019E-05 1.3274553E-05 5.2926018E-06 2 1.1043723E+06 1.7662751E-04 9.0794201E-05 4.5042275E-05 1.7965352E-05 3 2.3120171E+05 5.4344211E-04 2.8001279E-04 1.3911624E-04 5.5454889E-05 4 5.8261452E+04 1.6912942E-03 8.7590630E-04 4.3493714E-04 1.7365382E-04 5 1.7012091E+04 5.6737488E-03 2.9633931E-03 1.4785352E-03 5.8931410E-04 6 5.6557886E+03 1.9882435E-02 1.0519935E-02 5.2447517E-03 2.0980714E-03 7 2.1045185E+03 6.5604130E-02 3.5495581E-02 1.7876768E-02 7.1335846E-03 8 8.5804758E+02 1.8014427E-01 1.0142109E-01 5.1272553E-02 2.0598187E-02 9 3.7454479E+02 3.5328639E-01 2.1070454E-01 1.0908927E-01 4.3693278E-02 10 1.7184040E+02 3.8842206E-01 2.1659464E-01 1.0689862E-01 4.3190627E-02 11 8.0435133E+01 1.5998921E-01 -1.7698951E-01 -1.4443074E-01 -6.5448946E-02 12 3.9019471E+01 8.4555915E-03 -6.1434941E-01 -5.1730606E-01 -2.2704018E-01 13 1.9149586E+01 2.2996338E-03 -3.2269891E-01 -6.0436365E-02 -7.6878894E-03 14 8.8850749E+00 -1.3361058E-03 -2.8206180E-02 7.2891713E-01 4.8765516E-01 15 4.1899082E+00 5.9320332E-04 -5.3456908E-04 4.1918933E-01 2.0433782E-01 16 1.6897469E+00 -2.3609608E-04 1.5299786E-04 2.6502918E-02 -6.8468275E-01 17 6.7766221E-01 8.6231092E-05 -1.8711064E-05 -2.9104998E-04 -5.1192770E-01 18 1.4536215E-01 -2.0287727E-05 1.4409656E-05 8.5091518E-05 -3.6996640E-02 19 4.3187289E-02 7.3721247E-06 -5.0010805E-06 -2.8514018E-05 7.1588136E-03 3d 4d 5d 1 4.6002843E+03 1.0895475E-03 5.6452785E-04 1.6961989E-04 2 1.2365352E+03 9.3161172E-03 4.8639924E-03 1.4491484E-03 3 4.4941404E+02 4.9247317E-02 2.6015304E-02 7.8419283E-03 4 1.8847622E+02 1.6983694E-01 9.1686694E-02 2.7461712E-02 5 8.5714341E+01 3.6182984E-01 1.9479710E-01 5.9147868E-02 6 4.0767399E+01 4.1559088E-01 1.8133752E-01 5.0256679E-02 7 1.9582525E+01 1.8645476E-01 -1.8551832E-01 -7.3187075E-02 8 9.2604450E+00 1.9893560E-02 -5.4693321E-01 -2.1061836E-01 9 4.2736870E+00 1.3028740E-03 -3.7295605E-01 -6.3014959E-02 10 1.7010646E+00 -2.1110457E-04 -5.3469733E-02 3.8325183E-01 11 6.5750914E-01 9.9098970E-05 2.4658212E-03 5.3031893E-01 12 2.2065000E-01 -3.7230986E-05 -1.1232972E-03 3.0182872E-01 4f 1 3.9997272E+02 2.6737640E-03 2 1.3579890E+02 2.2046924E-02 3 5.6746619E+01 9.1728955E-02 4 2.5870174E+01 2.3466224E-01 5 1.2185153E+01 3.6732432E-01 6 5.6879984E+00 3.6775258E-01 7 2.5375087E+00 2.0815500E-01 8 9.9485802E-01 4.6408548E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0874159E+07 7.4981598E-06 2.9069340E-06 1.3907590E-06 6.9488556E-07 3.0001612E-07 8.8179723E-08 2 1.1304982E+07 5.6776778E-05 2.1984298E-05 1.0532368E-05 5.2585916E-06 2.2704625E-06 6.6728451E-07 3 3.1073467E+06 2.4608988E-04 9.5530603E-05 4.5705215E-05 2.2839585E-05 9.8610386E-06 2.8983520E-06 4 9.4045868E+05 9.3821181E-04 3.6394782E-04 1.7447865E-04 8.7106746E-05 3.7610480E-05 1.1053528E-05 5 3.0871304E+05 3.1872545E-03 1.2428207E-03 5.9483030E-04 2.9735198E-04 1.2838676E-04 3.7736240E-05 6 1.0810191E+05 9.9771640E-03 3.9007263E-03 1.8735027E-03 9.3545026E-04 4.0394193E-04 1.1871589E-04 7 4.0077299E+04 2.8593361E-02 1.1353863E-02 5.4483837E-03 2.7264712E-03 1.1774068E-03 3.4608979E-04 8 1.5619671E+04 7.4272944E-02 3.0135336E-02 1.4583340E-02 7.2910474E-03 3.1497179E-03 9.2571437E-04 9 6.3650098E+03 1.6698543E-01 7.2042601E-02 3.5055807E-02 1.7617645E-02 7.6147202E-03 2.2387338E-03 10 2.6989909E+03 2.9643470E-01 1.4199946E-01 7.1085546E-02 3.5783328E-02 1.5488477E-02 4.5531600E-03 11 1.1869469E+03 3.3566228E-01 1.9594536E-01 1.0063455E-01 5.1480480E-02 2.2330224E-02 6.5706843E-03 12 5.4083495E+02 1.6575380E-01 3.2113410E-02 1.1092683E-02 4.0371772E-03 1.6396950E-03 4.7022043E-04 13 2.3943008E+02 1.6427164E-02 -4.6901685E-01 -3.9616455E-01 -2.2527438E-01 -1.0052629E-01 -2.9692093E-02 14 1.1215195E+02 -3.5796656E-04 -5.6533232E-01 -6.1302246E-01 -3.8938765E-01 -1.7829363E-01 -5.2955195E-02 15 4.6894425E+01 -4.7623063E-05 -1.1300633E-01 4.0161832E-01 4.1337765E-01 2.1124150E-01 6.3957115E-02 16 2.4493222E+01 3.9397855E-05 1.7325399E-02 8.5274397E-01 1.0533958E+00 5.7463737E-01 1.7554501E-01 17 1.0148220E+01 -4.0280185E-05 -6.4776418E-03 1.3836726E-01 -5.1605504E-01 -4.2890269E-01 -1.3921638E-01 18 5.1705371E+00 3.1706374E-05 3.1390120E-03 -1.7084671E-02 -9.4579359E-01 -9.7967674E-01 -3.4304781E-01 19 1.6681143E+00 -1.5713582E-05 -1.0089186E-03 4.6201071E-03 -7.5243653E-02 7.6177629E-01 3.8544627E-01 20 7.8012050E-01 9.2591016E-06 4.4104889E-04 -2.0808554E-03 1.5093384E-02 6.6909295E-01 4.0016598E-01 21 1.6103441E-01 -3.9454420E-06 -8.3545766E-05 4.3449319E-04 -2.7798736E-03 3.2333086E-02 -5.8701144E-01 22 5.6807117E-02 2.5311670E-06 2.1804557E-05 -1.5426986E-04 1.0844446E-03 -4.0519813E-03 -6.1554257E-01 2p 3p 4p 5p 1 7.1559085E+06 9.4626358E-07 4.8692561E-07 2.4224403E-07 9.6432306E-08 2 1.1043723E+06 9.8220443E-06 5.0670928E-06 2.5090064E-06 1.0030120E-06 3 2.3120171E+05 7.6275104E-05 3.9468732E-05 1.9679696E-05 7.8305263E-06 4 5.8261452E+04 5.1609600E-04 2.6811465E-04 1.3295800E-04 5.3175747E-05 5 1.7012091E+04 3.0131105E-03 1.5732300E-03 7.8581571E-04 3.1290480E-04 6 5.6557886E+03 1.4628400E-02 7.7133405E-03 3.8397656E-03 1.5365293E-03 7 2.1045185E+03 5.7005917E-02 3.0684696E-02 1.5440386E-02 6.1581351E-03 8 8.5804758E+02 1.6951287E-01 9.4951354E-02 4.7937231E-02 1.9255925E-02 9 3.7454479E+02 3.4498116E-01 2.0497496E-01 1.0605031E-01 4.2465816E-02 10 1.7184040E+02 3.8502587E-01 2.1488294E-01 1.0617138E-01 4.2910485E-02 11 8.0435133E+01 1.5738838E-01 -1.7572705E-01 -1.4291332E-01 -6.4736775E-02 12 3.9019471E+01 5.4314530E-03 -6.1456636E-01 -5.1658115E-01 -2.2666415E-01 13 1.9149586E+01 -5.3537513E-04 -3.2352169E-01 -6.1381085E-02 -8.2123701E-03 14 8.8850749E+00 -3.6345147E-03 -2.8334669E-02 7.2850119E-01 4.8727134E-01 15 4.1899082E+00 -1.5892849E-03 -6.3184474E-04 4.1901582E-01 2.0432788E-01 16 1.6897469E+00 -2.0048560E-03 9.6598233E-05 2.6219306E-02 -6.8471330E-01 17 6.7766221E-01 -1.8441410E-03 -9.5645727E-05 -6.1473397E-04 -5.1201391E-01 18 1.4536215E-01 -1.8414356E-03 -5.0984376E-05 -2.2029761E-04 -3.7048316E-02 19 4.3187289E-02 -1.0048316E-03 -4.4272813E-05 -1.9811243E-04 7.1291875E-03 3d 4d 5d 1 4.6002843E+03 7.6045718E-04 3.9374782E-04 1.1851036E-04 2 1.2365352E+03 8.2393053E-03 4.2974844E-03 1.2794568E-03 3 4.4941404E+02 4.6872869E-02 2.4733461E-02 7.4555471E-03 4 1.8847622E+02 1.6649368E-01 8.9805564E-02 2.6892244E-02 5 8.5714341E+01 3.5903717E-01 1.9321217E-01 5.8665375E-02 6 4.0767399E+01 4.1451048E-01 1.8101410E-01 5.0186776E-02 7 1.9582525E+01 1.8606392E-01 -1.8500395E-01 -7.2971022E-02 8 9.2604450E+00 1.9533072E-02 -5.4665903E-01 -2.1048537E-01 9 4.2736870E+00 1.0637017E-03 -3.7290938E-01 -6.3044631E-02 10 1.7010646E+00 -3.5856243E-04 -5.3411556E-02 3.8319186E-01 11 6.5750914E-01 3.4466270E-05 2.5019931E-03 5.3030158E-01 12 2.2065000E-01 -8.3060668E-05 -1.1004510E-03 3.0181796E-01 4f 1 3.9997272E+02 2.5183947E-03 2 1.3579890E+02 2.1616600E-02 3 5.6746619E+01 9.1000332E-02 4 2.5870174E+01 2.3392871E-01 5 1.2185153E+01 3.6685244E-01 6 5.6879984E+00 3.6756472E-01 7 2.5375087E+00 2.0809687E-01 8 9.9485802E-01 4.6385590E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 5.0874159E+07 6.7251629E-04 -2.6544090E-04 1.2737345E-04 6.3630204E-05 -2.7477828E-05 -8.0780777E-06 2 1.1304982E+07 1.6663318E-03 -6.5919535E-04 3.1629834E-04 1.5824902E-04 -6.8312734E-05 -2.0073811E-05 3 3.1073467E+06 3.5173986E-03 -1.3946412E-03 6.6974383E-04 3.3446764E-04 -1.4446373E-04 -4.2477355E-05 4 9.4045868E+05 7.0020617E-03 -2.7932206E-03 1.3421883E-03 6.7191666E-04 -2.9004572E-04 -8.5220010E-05 5 3.0871304E+05 1.3705964E-02 -5.5160855E-03 2.6552692E-03 1.3265657E-03 -5.7314524E-04 -1.6854694E-04 6 1.0810191E+05 2.6841798E-02 -1.0954348E-02 5.2891748E-03 2.6495005E-03 -1.1438221E-03 -3.3602612E-04 7 4.0077299E+04 5.3217495E-02 -2.2212740E-02 1.0755865E-02 5.3839777E-03 -2.3271007E-03 -6.8436607E-04 8 1.5619671E+04 1.0540874E-01 -4.5414556E-02 2.2179651E-02 1.1132304E-02 -4.8119232E-03 -1.4141802E-03 9 6.3650098E+03 1.9743163E-01 -9.0885240E-02 4.4685616E-02 2.2473062E-02 -9.7173675E-03 -2.8571486E-03 10 2.6989909E+03 3.1098414E-01 -1.5963929E-01 8.0741817E-02 4.0775091E-02 -1.7654457E-02 -5.1892563E-03 11 1.1869469E+03 3.2551272E-01 -2.0377277E-01 1.0568498E-01 5.4173668E-02 -2.3531212E-02 -6.9280154E-03 12 5.4083495E+02 1.5147795E-01 -2.3399552E-02 5.4207989E-03 9.7559207E-04 -2.8269579E-04 -6.7586412E-05 13 2.3943008E+02 1.3664925E-02 4.7800012E-01 -4.0859697E-01 -2.3310520E-01 1.0411212E-01 3.0757063E-02 14 1.1215195E+02 -6.7644250E-04 5.6046214E-01 -6.1336939E-01 -3.9021915E-01 1.7872554E-01 5.3084743E-02 15 4.6894425E+01 -2.4696296E-05 1.1086607E-01 4.0720797E-01 4.1961454E-01 -2.1452313E-01 -6.4954818E-02 16 2.4493222E+01 -3.2269335E-05 -1.7517218E-02 8.5070366E-01 1.0532531E+00 -5.7476241E-01 -1.7559336E-01 17 1.0148220E+01 -1.6708384E-05 6.6666867E-03 1.3777355E-01 -5.1762217E-01 4.3039610E-01 1.3972298E-01 18 5.1705371E+00 4.7599001E-06 -3.2836764E-03 -1.7193905E-02 -9.4523041E-01 9.7955533E-01 3.4301842E-01 19 1.6681143E+00 -2.4402251E-06 1.0898635E-03 4.7261357E-03 -7.5071576E-02 -7.6202956E-01 -3.8560055E-01 20 7.8012050E-01 8.1811609E-07 -5.0252357E-04 -2.1567328E-03 1.5047140E-02 -6.6895248E-01 -4.0012057E-01 21 1.6103441E-01 -5.6053498E-07 1.1768400E-04 4.6911523E-04 -2.7673950E-03 -3.2342894E-02 5.8701434E-01 22 5.6807117E-02 1.7835889E-07 -4.6314918E-05 -1.7864608E-04 1.0758815E-03 4.0632374E-03 6.1554293E-01 2p 3p 4p 5p 1 7.1559085E+06 5.0160249E-05 -2.5564546E-05 1.2710272E-05 -5.0577875E-06 2 1.1043723E+06 1.8008265E-04 -9.2071434E-05 4.5482734E-05 -1.8172323E-05 3 2.3120171E+05 5.9218309E-04 -3.0407083E-04 1.5152237E-04 -6.0290225E-05 4 5.8261452E+04 1.9036520E-03 -9.8454541E-04 4.8766006E-04 -1.9495837E-04 5 1.7012091E+04 6.3091198E-03 -3.2921176E-03 1.6451882E-03 -6.5518460E-04 6 5.6557886E+03 2.1379822E-02 -1.1306655E-02 5.6323482E-03 -2.2542571E-03 7 2.1045185E+03 6.8568144E-02 -3.7099842E-02 1.8694036E-02 -7.4577485E-03 8 8.5804758E+02 1.8464875E-01 -1.0402858E-01 5.2591769E-02 -2.1132537E-02 9 3.7454479E+02 3.5742275E-01 -2.1348878E-01 1.1060128E-01 -4.4298979E-02 10 1.7184040E+02 3.8948085E-01 -2.1738786E-01 1.0731428E-01 -4.3372283E-02 11 8.0435133E+01 1.5932216E-01 1.7861190E-01 -1.4549256E-01 6.5918308E-02 12 3.9019471E+01 8.2882170E-03 6.1534697E-01 -5.1833844E-01 2.2750463E-01 13 1.9149586E+01 2.2799103E-03 3.2242534E-01 -5.9914772E-02 7.4439712E-03 14 8.8850749E+00 -1.3334861E-03 2.8149301E-02 7.2924188E-01 -4.8790578E-01 15 4.1899082E+00 5.9037427E-04 5.1639206E-04 4.1913480E-01 -2.0427251E-01 16 1.6897469E+00 -2.3542444E-04 -1.4741446E-04 2.6482460E-02 6.8474931E-01 17 6.7766221E-01 8.5865661E-05 1.6682391E-05 -2.9127091E-04 5.1192012E-01 18 1.4536215E-01 -2.0184690E-05 -1.4075319E-05 8.5280245E-05 3.6995066E-02 19 4.3187289E-02 7.3325846E-06 4.8763920E-06 -2.8559510E-05 -7.1588975E-03 3d 4d 5d 1 4.6002843E+03 1.1675723E-03 -6.0437576E-04 1.8180693E-04 2 1.2365352E+03 9.6256152E-03 -5.0252018E-03 1.4965688E-03 3 4.4941404E+02 5.0083845E-02 -2.6456661E-02 7.9760785E-03 4 1.8847622E+02 1.7128746E-01 -9.2488200E-02 2.7701080E-02 5 8.5714341E+01 3.6321506E-01 -1.9558530E-01 5.9392931E-02 6 4.0767399E+01 4.1606961E-01 -1.8153430E-01 5.0304616E-02 7 1.9582525E+01 1.8635884E-01 1.8590785E-01 -7.3321845E-02 8 9.2604450E+00 1.9864144E-02 5.4715431E-01 -2.1071434E-01 9 4.2736870E+00 1.2990647E-03 3.7295420E-01 -6.2992554E-02 10 1.7010646E+00 -2.1023753E-04 5.3457075E-02 3.8329058E-01 11 6.5750914E-01 9.8738060E-05 -2.4658101E-03 5.3032709E-01 12 2.2065000E-01 -3.7149860E-05 1.1232708E-03 3.0182866E-01 4f 1 3.9997272E+02 2.7184182E-03 2 1.3579890E+02 2.2205802E-02 3 5.6746619E+01 9.2032635E-02 4 2.5870174E+01 2.3501215E-01 5 1.2185153E+01 3.6754070E-01 6 5.6879984E+00 3.6782695E-01 7 2.5375087E+00 2.0816058E-01 8 9.9485802E-01 4.6407025E-02 ** Hg ** Large component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0789551E+07 2.7080835E-04 1.0574326E-04 5.0725761E-05 2.5423858E-05 1.1122127E-05 3.2244640E-06 2 1.1386854E+07 7.3510714E-04 2.8825443E-04 1.3842624E-04 6.9379511E-05 3.0352866E-05 8.7995661E-06 3 3.1540805E+06 1.7428394E-03 6.8812269E-04 3.3063527E-04 1.6580025E-04 7.2539724E-05 2.1030942E-05 4 9.6020321E+05 3.8967901E-03 1.5524758E-03 7.4762543E-04 3.7490602E-04 1.6404365E-04 4.7558218E-05 5 3.1659993E+05 8.6308209E-03 3.4880257E-03 1.6816488E-03 8.4417232E-04 3.6941425E-04 1.0710834E-04 6 1.1121757E+05 1.9110230E-02 7.8438495E-03 3.7973953E-03 1.9060350E-03 8.3424993E-04 2.4186270E-04 7 4.1324214E+04 4.2196609E-02 1.7756786E-02 8.6110126E-03 4.3308446E-03 1.8958984E-03 5.4976151E-04 8 1.6128830E+04 9.0842138E-02 3.9389358E-02 1.9264158E-02 9.6869315E-03 4.2422878E-03 1.2299463E-03 9 6.5780018E+03 1.8014235E-01 8.3242351E-02 4.0972766E-02 2.0702157E-02 9.0712661E-03 2.6311245E-03 10 2.7903753E+03 2.9564577E-01 1.5137339E-01 7.6526200E-02 3.8733425E-02 1.6995379E-02 4.9281858E-03 11 1.2272171E+03 3.2080198E-01 1.9782106E-01 1.0228298E-01 5.2549058E-02 2.3102312E-02 6.7076118E-03 12 5.5916653E+02 1.5595980E-01 2.5963914E-02 6.1805231E-03 1.2898542E-03 4.2248687E-04 1.0456998E-04 13 2.4769175E+02 1.5634903E-02 -4.7025829E-01 -4.0256484E-01 -2.3043551E-01 -1.0429693E-01 -3.0389273E-02 14 1.1605973E+02 -3.7324011E-04 -5.5996119E-01 -6.1208114E-01 -3.9048754E-01 -1.8131892E-01 -5.3175652E-02 15 4.8644847E+01 -6.7993921E-06 -1.1276195E-01 4.0053607E-01 4.1604646E-01 2.1602730E-01 6.4684711E-02 16 2.5421103E+01 3.4859216E-06 1.7371773E-02 8.5207081E-01 1.0582012E+00 5.8643726E-01 1.7697128E-01 17 1.0568426E+01 -1.4371909E-05 -6.6794681E-03 1.4035565E-01 -5.0872672E-01 -4.3233053E-01 -1.3886931E-01 18 5.4104250E+00 1.3956439E-05 3.3091755E-03 -1.7520610E-02 -9.5289402E-01 -1.0058036E+00 -3.5038653E-01 19 1.7666705E+00 -5.3859075E-06 -1.1089581E-03 4.7579486E-03 -7.6678525E-02 7.7972245E-01 3.9665475E-01 20 8.2534914E-01 2.3349327E-06 5.0390281E-04 -2.1387386E-03 1.4961727E-02 6.6956015E-01 3.9493109E-01 21 1.7032026E-01 -5.7061183E-07 -1.1620899E-04 4.5953116E-04 -2.7403094E-03 2.6712088E-02 -6.0841935E-01 22 5.9454674E-02 2.2047119E-07 4.4854998E-05 -1.7704473E-04 1.0122756E-03 -6.0456517E-03 -5.9769614E-01 2p 3p 4p 5p 1 7.6576952E+06 5.1974899E-05 2.6753522E-05 1.3330506E-05 5.3957653E-06 2 1.1923227E+06 1.7569262E-04 9.0528371E-05 4.5097707E-05 1.8260681E-05 3 2.5052910E+05 5.3679534E-04 2.7720163E-04 1.3829740E-04 5.5969004E-05 4 6.3171585E+04 1.6524070E-03 8.5774957E-04 4.2767397E-04 1.7333795E-04 5 1.8408884E+04 5.4743847E-03 2.8647622E-03 1.4353591E-03 5.8086276E-04 6 6.0959227E+03 1.9030742E-02 1.0091650E-02 5.0514039E-03 2.0512290E-03 7 2.2579791E+03 6.2806138E-02 3.4019068E-02 1.7204324E-02 6.9705288E-03 8 9.1681696E+02 1.7385989E-01 9.7964538E-02 4.9704495E-02 2.0267764E-02 9 3.9889673E+02 3.4688699E-01 2.0668360E-01 1.0741676E-01 4.3689689E-02 10 1.8261356E+02 3.9273062E-01 2.2297033E-01 1.1113115E-01 4.5583952E-02 11 8.5619496E+01 1.7005304E-01 -1.5427587E-01 -1.2910040E-01 -5.9707963E-02 12 4.1439121E+01 1.0974436E-02 -6.0985455E-01 -5.1582591E-01 -2.3037020E-01 13 2.0379329E+01 2.0953635E-03 -3.4147583E-01 -9.1830305E-02 -2.3527149E-02 14 9.4053012E+00 -1.2361377E-03 -3.2992073E-02 7.2342484E-01 4.9317058E-01 15 4.4460221E+00 5.5036443E-04 3.8921808E-05 4.3577547E-01 2.2363308E-01 16 1.7924529E+00 -2.1886838E-04 -3.0243991E-05 2.8804027E-02 -6.9570134E-01 17 7.1850221E-01 8.0329331E-05 4.6788277E-05 -4.9514953E-04 -5.1018308E-01 18 1.5261483E-01 -1.8576828E-05 -1.1552565E-06 1.1090241E-04 -3.3832739E-02 19 4.4700120E-02 6.7016716E-06 5.0511309E-07 -4.0438603E-05 6.3205627E-03 3d 4d 5d 1 4.7992655E+03 1.0784473E-03 5.6277477E-04 1.7606582E-04 2 1.2865706E+03 9.1976660E-03 4.8371947E-03 1.5007555E-03 3 4.6683344E+02 4.8702024E-02 2.5911254E-02 8.1336054E-03 4 1.9560113E+02 1.6853376E-01 9.1646285E-02 2.8589111E-02 5 8.8925495E+01 3.6065910E-01 1.9562987E-01 6.1865909E-02 6 4.2304153E+01 4.1628236E-01 1.8351313E-01 5.2947533E-02 7 2.0338078E+01 1.8813068E-01 -1.8446002E-01 -7.6491954E-02 8 9.6359751E+00 2.0295419E-02 -5.4814151E-01 -2.2126127E-01 9 4.4719227E+00 1.2960862E-03 -3.7173667E-01 -6.3797608E-02 10 1.8012011E+00 -2.1546561E-04 -5.2907841E-02 4.0030787E-01 11 7.0112189E-01 1.0932480E-04 2.6360498E-03 5.3748129E-01 12 2.3690203E-01 -3.3214315E-05 -8.7971060E-04 2.7185224E-01 4f 1 4.2418162E+02 2.5599775E-03 2 1.4399163E+02 2.1269910E-02 3 6.0256702E+01 8.9440804E-02 4 2.7524802E+01 2.3152905E-01 5 1.3011744E+01 3.6679554E-01 6 6.1072967E+00 3.6978207E-01 7 2.7450167E+00 2.0831834E-01 8 1.0847115E+00 4.5078296E-02 Small component functions ------------------------- 1s 2s 3s 4s 5s 6s 1 5.0789551E+07 7.8240054E-06 3.0475401E-06 1.4604523E-06 7.3210255E-07 3.2025884E-07 9.2851005E-08 2 1.1386854E+07 5.8838907E-05 2.2890636E-05 1.0984441E-05 5.5023908E-06 2.4070932E-06 6.9780288E-07 3 3.1540805E+06 2.5255346E-04 9.8502992E-05 4.7205975E-05 2.3666961E-05 1.0353213E-05 3.0017009E-06 4 9.6020321E+05 9.5544484E-04 3.7240031E-04 1.7882167E-04 8.9569822E-05 3.9184597E-05 1.1359169E-05 5 3.1659993E+05 3.2237034E-03 1.2629929E-03 6.0550275E-04 3.0368017E-04 1.3285100E-04 3.8518713E-05 6 1.1121757E+05 1.0036135E-02 3.9424570E-03 1.8966222E-03 9.5012820E-04 4.1569737E-04 1.2050392E-04 7 4.1324214E+04 2.8632580E-02 1.1421747E-02 5.4902245E-03 2.7564137E-03 1.2060643E-03 3.4971073E-04 8 1.6128830E+04 7.4117050E-02 3.0202267E-02 1.4638733E-02 7.3429980E-03 3.2140517E-03 9.3171763E-04 9 6.5780018E+03 1.6625219E-01 7.1969592E-02 3.5076195E-02 1.7685248E-02 7.7449941E-03 2.2462768E-03 10 2.7903753E+03 2.9499353E-01 1.4150981E-01 7.0925240E-02 3.5819668E-02 1.5708991E-02 4.5546891E-03 11 1.2272171E+03 3.3492945E-01 1.9480761E-01 1.0011791E-01 5.1370749E-02 2.2577153E-02 6.5548309E-03 12 5.5916653E+02 1.6674804E-01 3.1523858E-02 1.0437201E-02 3.6740174E-03 1.4935566E-03 4.1655593E-04 13 2.4769175E+02 1.6862338E-02 -4.6728800E-01 -3.9538491E-01 -2.2573040E-01 -1.0210670E-01 -2.9747477E-02 14 1.1605973E+02 -3.8794701E-04 -5.6508915E-01 -6.1281621E-01 -3.9055677E-01 -1.8130716E-01 -5.3170259E-02 15 4.8644847E+01 -3.0873649E-05 -1.1390613E-01 3.9773657E-01 4.1207962E-01 2.1382983E-01 6.4022486E-02 16 2.5421103E+01 3.0364585E-05 1.7336073E-02 8.5438613E-01 1.0589448E+00 5.8670317E-01 1.7704262E-01 17 1.0568426E+01 -3.6931280E-05 -6.5504936E-03 1.4052373E-01 -5.0817940E-01 -4.3150014E-01 -1.3857621E-01 18 5.4104250E+00 3.0552180E-05 3.1913744E-03 -1.7400019E-02 -9.5340595E-01 -1.0059375E+00 -3.5042590E-01 19 1.7666705E+00 -1.5555689E-05 -1.0221214E-03 4.6658372E-03 -7.6775490E-02 7.7963067E-01 3.9656710E-01 20 8.2534914E-01 9.2199949E-06 4.4059365E-04 -2.0723018E-03 1.5001691E-02 6.6967536E-01 3.9496505E-01 21 1.7032026E-01 -3.9968413E-06 -8.2134363E-05 4.2406955E-04 -2.7567819E-03 2.6695593E-02 -6.0842431E-01 22 5.9454674E-02 2.5872159E-06 2.0631696E-05 -1.5190624E-04 1.0230447E-03 -6.0330923E-03 -5.9769443E-01 2p 3p 4p 5p 1 7.6576952E+06 9.1874145E-07 4.7374469E-07 2.3670642E-07 9.5671096E-08 2 1.1923227E+06 9.4119585E-06 4.8685317E-06 2.4203387E-06 9.8214099E-07 3 2.5052910E+05 7.2199921E-05 3.7433621E-05 1.8747218E-05 7.5740562E-06 4 6.3171585E+04 4.8433528E-04 2.5230751E-04 1.2561777E-04 5.0998141E-05 5 1.8408884E+04 2.8231111E-03 1.4769745E-03 7.4098623E-04 2.9958002E-04 6 6.0959227E+03 1.3764078E-02 7.2750281E-03 3.6358776E-03 1.4768985E-03 7 2.2579791E+03 5.4104819E-02 2.9152402E-02 1.4730605E-02 5.9651068E-03 8 9.1681696E+02 1.6293949E-01 9.1333794E-02 4.6275018E-02 1.8866817E-02 9 3.9889673E+02 3.3814255E-01 2.0067458E-01 1.0421860E-01 4.2378103E-02 10 1.8261356E+02 3.8909065E-01 2.2101606E-01 1.1025984E-01 4.5239472E-02 11 8.5619496E+01 1.6742838E-01 -1.5299191E-01 -1.2756505E-01 -5.8976397E-02 12 4.1439121E+01 7.8545957E-03 -6.0998280E-01 -5.1497671E-01 -2.2992568E-01 13 2.0379329E+01 -8.3471952E-04 -3.4235694E-01 -9.2801774E-02 -2.4071894E-02 14 9.4053012E+00 -3.6401164E-03 -3.3132524E-02 7.2296436E-01 4.9274389E-01 15 4.4460221E+00 -1.6902495E-03 -6.0120693E-05 4.3560573E-01 2.2362618E-01 16 1.7924529E+00 -2.0604397E-03 -8.6161178E-05 2.8508124E-02 -6.9573288E-01 17 7.1850221E-01 -1.9194247E-03 -3.1789102E-05 -8.3277551E-04 -5.1027394E-01 18 1.5261483E-01 -1.9220034E-03 -6.7386783E-05 -2.1032572E-04 -3.3886746E-02 19 4.4700120E-02 -1.0367319E-03 -3.9270470E-05 -2.1641940E-04 6.2899674E-03 3d 4d 5d 1 4.7992655E+03 7.4445925E-04 3.8821464E-04 1.2166854E-04 2 1.2865706E+03 8.0990261E-03 4.2550799E-03 1.3191800E-03 3 4.6683344E+02 4.6269705E-02 2.4588879E-02 7.7184832E-03 4 1.9560113E+02 1.6508973E-01 8.9694612E-02 2.7973668E-02 5 8.8925495E+01 3.5776736E-01 1.9397590E-01 6.1341368E-02 6 4.2304153E+01 4.1515797E-01 1.8317045E-01 5.2870431E-02 7 2.0338078E+01 1.8772814E-01 -1.8392285E-01 -7.6255085E-02 8 9.6359751E+00 1.9923082E-02 -5.4785489E-01 -2.2111511E-01 9 4.4719227E+00 1.0497128E-03 -3.7169019E-01 -6.3832446E-02 10 1.8012011E+00 -3.6880358E-04 -5.2847157E-02 4.0024189E-01 11 7.0112189E-01 4.1213257E-05 2.6743462E-03 5.3746303E-01 12 2.3690203E-01 -8.1611932E-05 -8.5539592E-04 2.7184067E-01 4f 1 4.2418162E+02 2.4031987E-03 2 1.4399163E+02 2.0829490E-02 3 6.0256702E+01 8.8684310E-02 4 2.7524802E+01 2.3075457E-01 5 1.3011744E+01 3.6629087E-01 6 6.1072967E+00 3.6958012E-01 7 2.7450167E+00 2.0825661E-01 8 1.0847115E+00 4.5053001E-02 Foldy-Wouthuysen functions -------------------------- 1s 2s 3s 4s 5s 6s 1 5.0789551E+07 7.0999359E-04 -2.8156309E-04 1.3533313E-04 6.7829683E-05 -2.9678753E-05 -8.6068696E-06 2 1.1386854E+07 1.7477535E-03 -6.9470367E-04 3.3388430E-04 1.6759388E-04 -7.3300063E-05 -2.1244776E-05 3 3.1540805E+06 3.6651357E-03 -1.4601712E-03 7.0238611E-04 3.5192928E-04 -1.5401971E-04 -4.4675672E-05 4 9.6020321E+05 7.2492456E-03 -2.9058794E-03 1.3986198E-03 7.0246541E-04 -3.0722366E-04 -8.9029138E-05 5 3.1659993E+05 1.4098041E-02 -5.7018987E-03 2.7493852E-03 1.3781362E-03 -6.0332421E-04 -1.7503258E-04 6 1.1121757E+05 2.7415675E-02 -1.1246438E-02 5.4392432E-03 2.7337127E-03 -1.1957093E-03 -3.4644479E-04 7 4.1324214E+04 5.3944062E-02 -2.2636252E-02 1.0980645E-02 5.5147064E-03 -2.4152283E-03 -7.0072269E-04 8 1.6128830E+04 1.0605309E-01 -4.5942505E-02 2.2476507E-02 1.1319329E-02 -4.9572844E-03 -1.4369226E-03 9 6.5780018E+03 1.9744176E-01 -9.1330063E-02 4.4986991E-02 2.2699360E-02 -9.9455058E-03 -2.8848981E-03 10 2.7903753E+03 3.0995431E-01 -1.5959804E-01 8.0837903E-02 4.0960596E-02 -1.7968677E-02 -5.2089315E-03 11 1.2272171E+03 3.2464361E-01 -2.0281382E-01 1.0528142E-01 5.4132134E-02 -2.3825680E-02 -6.9218725E-03 12 5.5916653E+02 1.5207345E-01 -2.2589320E-02 4.5888264E-03 5.0308095E-04 -6.8528556E-05 1.0590664E-06 13 2.4769175E+02 1.3972120E-02 4.7653790E-01 -4.0818925E-01 -2.3382756E-01 1.0586601E-01 3.0849046E-02 14 1.1605973E+02 -7.1400433E-04 5.6010114E-01 -6.1320901E-01 -3.9143919E-01 1.8177129E-01 5.3308169E-02 15 4.8644847E+01 -9.8687327E-06 1.1167690E-01 4.0352596E-01 4.1855546E-01 -2.1728863E-01 -6.5062030E-02 16 2.5421103E+01 -4.2766350E-05 -1.7532200E-02 8.5229245E-01 1.0588246E+00 -5.8685472E-01 -1.7709932E-01 17 1.0568426E+01 -1.2523638E-05 6.7438582E-03 1.3989960E-01 -5.0982957E-01 4.3309765E-01 1.3911376E-01 18 5.4104250E+00 2.4046342E-06 -3.3406138E-03 -1.7514398E-02 -9.5281824E-01 1.0058095E+00 3.5039600E-01 19 1.7666705E+00 -1.6337024E-06 1.1049595E-03 4.7761074E-03 -7.6591103E-02 -7.7990545E-01 -3.9673493E-01 20 8.2534914E-01 4.1561547E-07 -5.0299443E-04 -2.1504632E-03 1.4952660E-02 -6.6952348E-01 -3.9491560E-01 21 1.7032026E-01 -4.7606716E-07 1.1649504E-04 4.5921727E-04 -2.7437070E-03 -2.6706356E-02 6.0842711E-01 22 5.9454674E-02 1.4184036E-07 -4.5253391E-05 -1.7654705E-04 1.0141952E-03 6.0450564E-03 5.9769481E-01 2p 3p 4p 5p 1 7.6576952E+06 4.9908188E-05 -2.5491072E-05 1.2727732E-05 -5.1425205E-06 2 1.1923227E+06 1.7864460E-04 -9.1568184E-05 4.5419983E-05 -1.8419697E-05 3 2.5052910E+05 5.8375824E-04 -3.0035483E-04 1.5031156E-04 -6.0729424E-05 4 6.3171585E+04 1.8607779E-03 -9.6471939E-04 4.7977262E-04 -1.9468770E-04 5 1.8408884E+04 6.1043652E-03 -3.1913504E-03 1.6017177E-03 -6.4767945E-04 6 6.0959227E+03 2.0525189E-02 -1.0879261E-02 5.4409265E-03 -2.2104391E-03 7 2.2579791E+03 6.5780648E-02 -3.5630245E-02 1.8028816E-02 -7.3028275E-03 8 9.1681696E+02 1.7844425E-01 -1.0061700E-01 5.1050670E-02 -2.0820840E-02 9 3.9889673E+02 3.5122291E-01 -2.0957721E-01 1.0899064E-01 -4.4330042E-02 10 1.8261356E+02 3.9396378E-01 -2.2391878E-01 1.1163487E-01 -4.5805035E-02 11 8.5619496E+01 1.6936893E-01 1.5590632E-01 -1.3015951E-01 6.0182188E-02 12 4.1439121E+01 1.0785845E-02 6.1095716E-01 -5.1695543E-01 2.3088774E-01 13 2.0379329E+01 2.0714079E-03 3.4120640E-01 -9.1314698E-02 2.3282937E-02 14 9.4053012E+00 -1.2325165E-03 3.2924543E-02 7.2378520E-01 -4.9344879E-01 15 4.4460221E+00 5.4707799E-04 -5.8431920E-05 4.3571996E-01 -2.2356554E-01 16 1.7924529E+00 -2.1812364E-04 3.6373611E-05 2.8781169E-02 6.9577459E-01 17 7.1850221E-01 7.9927221E-05 -4.9002810E-05 -4.9527964E-04 5.1017435E-01 18 1.5261483E-01 -1.8463182E-05 1.5096587E-06 1.1109217E-04 3.3831163E-02 19 4.4700120E-02 6.6582373E-06 -6.3504865E-07 -4.0485195E-05 -6.3206734E-03 3d 4d 5d 1 4.7992655E+03 1.1578645E-03 -6.0362802E-04 1.8907524E-04 2 1.2865706E+03 9.5131559E-03 -5.0027438E-03 1.5514651E-03 3 4.6683344E+02 4.9557217E-02 -2.6365658E-02 8.2774358E-03 4 1.9560113E+02 1.7002467E-01 -9.2476074E-02 2.8847246E-02 5 8.8925495E+01 3.6209354E-01 -1.9645216E-01 6.2132218E-02 6 4.2304153E+01 4.1678386E-01 -1.8372269E-01 5.3000963E-02 7 2.0338078E+01 1.8803226E-01 1.8486565E-01 -7.6638897E-02 8 9.6359751E+00 2.0264343E-02 5.4837358E-01 -2.2136698E-01 9 4.4719227E+00 1.2920081E-03 3.7173415E-01 -6.3772060E-02 10 1.8012011E+00 -2.1452536E-04 5.2894358E-02 4.0035082E-01 11 7.0112189E-01 1.0893457E-04 -2.6360637E-03 5.3748975E-01 12 2.3690203E-01 -3.3126542E-05 8.7968110E-04 2.7185184E-01 4f 1 4.2418162E+02 2.6048494E-03 2 1.4399163E+02 2.1431432E-02 3 6.0256702E+01 8.9754854E-02 4 2.7524802E+01 2.3189767E-01 5 1.3011744E+01 3.6702835E-01 6 6.1072967E+00 3.6986288E-01 7 2.7450167E+00 2.0832405E-01 8 1.0847115E+00 4.5076533E-02 Exponents of valence correlating and polarizing functions ========================================================= f cor f pol Hf 3.8547549E-01 1.1195327E-01 Ta 4.7476634E-01 1.4059344E-01 W 5.6143065E-01 1.5925621E-01 Re 6.4713929E-01 1.9237380E-01 Os 7.3285164E-01 2.1776801E-01 Ir 8.1914535E-01 2.4625192E-01 Pt 9.0639763E-01 2.6863666E-01 Au 9.9485802E-01 3.0537602E-01 Hg 1.0847115E+00 3.4059395E-01 Exponents of 4f core correlating functions ========================================== g Hf 7.1448282E+00 Ta 7.7301267E+00 W 8.3273766E+00 Re 8.9360799E+00 Os 9.5561343E+00 Ir 1.0187605E+01 Pt 1.0830621E+01 Au 1.1485338E+01 Hg 1.2151916E+01