(1s 2 2s 2 2p 2 5d 1 ) 4 P N 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4152.
N.V.Novikov // Wave Function Value Database;
http://cdfe.sinp.msu.ru/services/wftables/
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 5d- electron | |
| 1 | 3d | .266840 | 1.37484784 |
| 2 | 4d | .208310 | -4.46535631 |
| 3 | 5d | .197513 | 3.91899258 |
| 4 | 3d | 1.645885 | .00405139 |
| 5 | 4d | .147173 | -.09587452 |
| 6 | 5d | 1.157211 | .00628788 |
| 7 | 4d | 5.801763 | .00009960 |
| ORB.ENERGY,a.u. | -.020249 | ||
| NORM | 1.000018 | < R > | 34.028321 | < R2 > | 1314.376921 | < 1/R > | .040857 | < 1/R**2 > | .003437 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 1.742860 | .72366413 |
| 2 | 2p | 2.982950 | .28737649 |
| 3 | 2p | 6.680629 | .01728009 |
| 4 | 3p | 1.005264 | .02634330 |
| 5 | 5p | 1.185600 | -.01152105 |
| 6 | 2p | 6.772626 | .00313998 |
| 7 | 5p | 8.203061 | .00473837 |
| 8 | 5p | 13.318996 | .00013193 |
| ORB.ENERGY,a.u. | -1.008800 | ||
| NORM | 1.000000 | < R > | 1.243704 | < R2 > | 1.932454 | < 1/R > | 1.055917 | < 1/R**2 > | 1.580373 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 5.896124 | .28636862 |
| 2 | 2s | 2.455688 | -.83283723 |
| 3 | 3s | 1.975534 | -.26796585 |
| 4 | 4s | 8.356255 | .02225506 |
| 5 | 3s | 10.149896 | .00710052 |
| 6 | 5s | 2.926359 | -.01394288 |
| 7 | 5s | 16.711744 | .00084192 |
| ORB.ENERGY,a.u. | -.654320 | ||
| NORM | 1.000000 | < R > | 1.252839 | < R2 > | 1.874240 | < 1/R > | 1.140840 | < 1/R**2 > | 5.286928 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.229987 | .71795557 |
| 2 | 1s | 9.302394 | .22515042 |
| 3 | 1s | 2.644962 | .00479838 |
| 4 | 2s | 6.904648 | .08344681 |
| 5 | 3s | 7.780812 | -.02157521 |
| 6 | 4s | 12.684999 | .00689592 |
| 7 | 5s | 28.104372 | .00017005 |
| ORB.ENERGY,a.u. | -15.024000 |
| NORM | 1.000000 | < R > | .228085 | < R2 > | .070094 | < 1/R > | 6.656725 | < 1/R**2 > | 89.910941 |
Total Energy= -53.90838310 a.u.
Kinetic Energy= 53.90825684 a.u.
Potential Energy= -107.81663995 a.u.
Virial Ratio = -2.00000234