(1s 2 2s 2 2p 5 4p 1 ) 1 D Na +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1241.
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 | 4p- electron | |
| 1 | 2p | 4.038926 | .12571499 |
| 2 | 3p | .460543 | 1.86013278 |
| 3 | 4p | 1.180858 | -.51285362 |
| 4 | 5p | 2.286612 | -.09402519 |
| 5 | 3p | 5.609266 | -.03043470 |
| 6 | 5p | .535333 | -.69149815 |
| 7 | 4p | 15.580744 | -.00059365 |
| 8 | 3p | .704452 | -.69420478 |
| 9 | 4p | .556776 | .47310438 |
| 10 | 3p | 20.595540 | -.00010646 |
| ORB.ENERGY,a.u. | -.178720 | ||
| NORM | 1.000003 | < R > | 7.978094 | < R2 > | 72.107399 | < 1/R > | .169320 | < 1/R**2 > | .082372 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.536147 | 1.53019955 |
| 2 | 3p | 4.801169 | -.69443780 |
| 3 | 4p | 6.063461 | .12153363 |
| 4 | 5p | 3.259216 | .07845299 |
| 5 | 4p | 15.949974 | -.00375204 |
| 6 | 4p | .520382 | .00120951 |
| 7 | 5p | 31.908307 | -.00012786 |
| 8 | 3p | 22.751572 | -.00050607 |
| ORB.ENERGY,a.u. | -2.372600 | ||
| NORM | 1.000000 | < R > | .738695 | < R2 > | .689318 | < 1/R > | 1.796645 | < 1/R**2 > | 4.608547 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.123894 | .32116787 |
| 2 | 2s | 4.172415 | -.80999806 |
| 3 | 3s | 3.321329 | -.32035508 |
| 4 | 4s | 14.671268 | .01132869 |
| 5 | 3s | 18.530487 | .00222623 |
| 6 | 5s | 29.493912 | .00034815 |
| 7 | 5s | 2.328563 | -.00541107 |
| 8 | 4s | 2.667256 | .00745412 |
| 9 | 3s | 1.456152 | .00238192 |
| ORB.ENERGY,a.u. | -2.975600 | ||
| NORM | 1.000000 | < R > | .753248 | < R2 > | .678503 | < 1/R > | 1.926454 | < 1/R**2 > | 15.307853 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.229865 | .91337179 |
| 2 | 1s | 15.493172 | .08642340 |
| 3 | 2s | 5.347419 | .01504125 |
| 4 | 3s | 7.014328 | -.01793793 |
| 5 | 4s | 9.110200 | .01105922 |
| 6 | 5s | 25.884442 | .00104596 |
| 7 | 4s | 58.385183 | -.00005798 |
| ORB.ENERGY,a.u. | -39.982000 |
| NORM | 1.000000 | < R > | .142774 | < R2 > | .027439 | < 1/R > | 10.610970 | < 1/R**2 > | 227.648826 |
Total Energy= -160.17668244 a.u.
Kinetic Energy= 160.17611560 a.u.
Potential Energy= -320.35279803 a.u.
Virial Ratio = -2.00000354