(1s 2 2s 2 2p 4 3s 1 ) 4 P Na 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4130.
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 | 3s- electron | |
| 1 | 1s | 9.408738 | .10344817 |
| 2 | 2s | 3.175556 | -.45861158 |
| 3 | 3s | 1.554626 | 1.08131941 |
| 4 | 4s | 9.061117 | -.01860195 |
| 5 | 5s | 1.439588 | .05498291 |
| 6 | 4s | 1.227756 | -.02182080 |
| 7 | 5s | 5.217496 | .03060414 |
| 8 | 5s | 46.256841 | -.00005436 |
| 9 | 4s | 73.556551 | -.00000994 |
| ORB.ENERGY,a.u. | -.948860 | ||
| NORM | 1.000000 | < R > | 2.423543 | < R2 > | 6.691547 | < 1/R > | .559652 | < 1/R**2 > | 1.839798 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.183713 | 1.27283797 |
| 2 | 2p | 8.087696 | .08201668 |
| 3 | 3p | 3.829850 | -.35936659 |
| 4 | 4p | 9.052549 | .02222222 |
| 5 | 5p | 28.890308 | -.00014625 |
| 6 | 5p | 2.892707 | .01838057 |
| 7 | 4p | 2.797940 | -.01444440 |
| ORB.ENERGY,a.u. | -3.061800 | ||
| NORM | 1.000000 | < R > | .693065 | < R2 > | .599792 | < 1/R > | 1.889233 | < 1/R**2 > | 5.023520 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 10.029529 | .28712964 |
| 2 | 2s | 3.324368 | -.78539618 |
| 3 | 3s | 5.685214 | -.23284849 |
| 4 | 4s | 1.899183 | -.01178373 |
| 5 | 5s | 11.118510 | -.02400811 |
| 6 | 4s | 12.629018 | -.01233531 |
| 7 | 3s | 1.048484 | -.00049178 |
| 8 | 2s | 56.648185 | .00002401 |
| 9 | 4s | 74.147041 | .00001833 |
| 10 | 4s | 1.207872 | -.00062695 |
| ORB.ENERGY,a.u. | -3.726900 | ||
| NORM | 1.000000 | < R > | .732485 | < R2 > | .640545 | < 1/R > | 1.983472 | < 1/R**2 > | 16.178835 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.237909 | .91105949 |
| 2 | 1s | 15.407577 | .08810820 |
| 3 | 2s | 5.165963 | .01863568 |
| 4 | 3s | 6.476949 | -.01963055 |
| 5 | 4s | 8.512790 | .00885501 |
| 6 | 5s | 26.484894 | .00105104 |
| 7 | 4s | 59.295413 | -.00004981 |
| 8 | 5s | 2.115719 | .00036299 |
| ORB.ENERGY,a.u. | -41.160000 |
| NORM | 1.000000 | < R > | .142627 | < R2 > | .027367 | < 1/R > | 10.617414 | < 1/R**2 > | 227.855729 |
Total Energy= -158.35900990 a.u.
Kinetic Energy= 158.37150465 a.u.
Potential Energy= -316.73051454 a.u.
Virial Ratio = -1.99992110