(1s 2 2s 2 2p 5 5p 1 ) 3 P Na +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3151.
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 | 5p- electron | |
| 1 | 2p | 2.704430 | .05951582 |
| 2 | 3p | .901414 | -.64077364 |
| 3 | 4p | .534030 | 2.12174848 |
| 4 | 5p | .470745 | -2.41749010 |
| 5 | 2p | 5.949825 | .02457648 |
| 6 | 5p | 8.082356 | .00321405 |
| 7 | 4p | .534069 | .21011858 |
| 8 | 4p | 20.844343 | -.00016881 |
| ORB.ENERGY,a.u. | -.105250 | ||
| NORM | 1.000001 | < R > | 13.807482 | < R2 > | 214.639364 | < 1/R > | .101425 | < 1/R**2 > | .038559 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 2.841033 | 1.40056021 |
| 2 | 3p | 3.452847 | -.50489425 |
| 3 | 2p | 7.719096 | .10229000 |
| 4 | 4p | 8.708992 | .02734209 |
| 5 | 5p | 2.292887 | .02940380 |
| 6 | 4p | 2.069338 | -.03436442 |
| 7 | 5p | 26.741313 | -.00017043 |
| 8 | 4p | 13.963753 | .00057486 |
| ORB.ENERGY,a.u. | -2.451400 | ||
| NORM | 1.000000 | < R > | .738636 | < R2 > | .689185 | < 1/R > | 1.796850 | < 1/R**2 > | 4.609593 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.122855 | .32129048 |
| 2 | 2s | 4.170158 | -.81170224 |
| 3 | 3s | 3.308709 | -.32125091 |
| 4 | 4s | 14.623689 | .01129286 |
| 5 | 3s | 18.294509 | .00232989 |
| 6 | 5s | 29.400083 | .00034541 |
| 7 | 5s | 2.380057 | -.00647853 |
| 8 | 4s | 2.720001 | .01062372 |
| 9 | 3s | 1.543976 | .00306898 |
| ORB.ENERGY,a.u. | -2.975600 | ||
| NORM | 1.000000 | < R > | .753067 | < R2 > | .678125 | < 1/R > | 1.926867 | < 1/R**2 > | 15.313853 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.229990 | .91336731 |
| 2 | 1s | 15.492227 | .08642720 |
| 3 | 2s | 5.346201 | .01504275 |
| 4 | 3s | 7.013850 | -.01793951 |
| 5 | 4s | 9.111706 | .01105585 |
| 6 | 5s | 25.874748 | .00104744 |
| 7 | 4s | 58.440737 | -.00005875 |
| ORB.ENERGY,a.u. | -39.982000 |
| NORM | 1.000000 | < R > | .142773 | < R2 > | .027438 | < 1/R > | 10.611029 | < 1/R**2 > | 227.650742 |
Total Energy= -160.10323005 a.u.
Kinetic Energy= 160.10263647 a.u.
Potential Energy= -320.20586652 a.u.
Virial Ratio = -2.00000371