(1s 2 2s 2 2p 5 3s 1 ) 1 P Na +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1130.
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 | 9.448631 | .06577254 |
| 2 | 2s | 3.323956 | -.25588221 |
| 3 | 3s | 1.308744 | .85082612 |
| 4 | 4s | 8.854060 | -.01272476 |
| 5 | 5s | 3.564316 | -.02979428 |
| 6 | 4s | 1.053853 | .28496676 |
| 7 | 5s | 1.033595 | -.05959450 |
| 8 | 5s | 60.226249 | -.00001481 |
| 9 | 3s | .605803 | .00380286 |
| ORB.ENERGY,a.u. | -.505290 | ||
| NORM | 1.000000 | < R > | 3.051083 | < R2 > | 10.606860 | < 1/R > | .415203 | < 1/R**2 > | .819322 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 2.783945 | 1.42970449 |
| 2 | 3p | 3.365871 | -.54023865 |
| 3 | 2p | 7.588983 | .10965616 |
| 4 | 4p | 8.674777 | .02655752 |
| 5 | 5p | 2.124817 | .04062226 |
| 6 | 4p | 1.903212 | -.04684287 |
| 7 | 5p | 27.913579 | -.00014122 |
| 8 | 3p | 16.509974 | -.00013685 |
| ORB.ENERGY,a.u. | -2.161100 | ||
| NORM | 1.000000 | < R > | .741156 | < R2 > | .694866 | < 1/R > | 1.792667 | < 1/R**2 > | 4.591859 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 10.124982 | .27545872 |
| 2 | 2s | 3.143234 | -.76221412 |
| 3 | 3s | 6.428512 | -.22729486 |
| 4 | 4s | 5.518429 | -.06302573 |
| 5 | 5s | 12.594891 | -.01059483 |
| 6 | 5s | 1.558665 | .00692238 |
| 7 | 3s | 82.325463 | -.00000937 |
| 8 | 4s | 46.879715 | -.00008360 |
| 9 | 2s | .149628 | .00109520 |
| 10 | 4s | .257160 | -.00098554 |
| ORB.ENERGY,a.u. | -2.975600 | ||
| NORM | 1.000000 | < R > | .750228 | < R2 > | .671711 | < 1/R > | 1.932127 | < 1/R**2 > | 15.384839 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.232725 | .91321484 |
| 2 | 1s | 15.483902 | .08637225 |
| 3 | 2s | 5.607521 | .01354621 |
| 4 | 3s | 7.435197 | -.01522782 |
| 5 | 4s | 9.513949 | .01005946 |
| 6 | 5s | 26.061056 | .00117575 |
| 7 | 4s | 61.850694 | -.00004642 |
| 8 | 5s | 1.712811 | -.00033447 |
| ORB.ENERGY,a.u. | -39.982000 |
| NORM | 1.000000 | < R > | .142777 | < R2 > | .027441 | < 1/R > | 10.610864 | < 1/R**2 > | 227.644800 |
Total Energy= -160.51136617 a.u.
Kinetic Energy= 160.50212779 a.u.
Potential Energy= -321.01349395 a.u.
Virial Ratio = -2.00005756