(1s 2 2s 2 2p 1 3s 1 ) 1 P Na 5+
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 | 9.040519 | .15250847 |
| 2 | 2s | 3.029203 | -.88219805 |
| 3 | 3s | 2.320582 | 1.49578320 |
| 4 | 4s | 6.851256 | -.03216355 |
| 5 | 5s | 12.238620 | -.00811670 |
| 6 | 5s | 2.157895 | .00419046 |
| 7 | 4s | 21.987753 | .00026303 |
| ORB.ENERGY,a.u. | -2.588000 | ||
| NORM | 1.000000 | < R > | 1.773807 | < R2 > | 3.537925 | < 1/R > | .772138 | < 1/R**2 > | 3.413036 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 4.088918 | 1.11237359 |
| 2 | 3p | 4.921796 | -.14337702 |
| 3 | 2p | 8.987004 | .03525361 |
| 4 | 5p | 6.547180 | .00430178 |
| 5 | 4p | 18.420313 | -.00293065 |
| 6 | 5p | 45.938744 | -.00016661 |
| 7 | 5p | 96.123976 | -.00001937 |
| 8 | 4p | 2.239182 | -.00041914 |
| ORB.ENERGY,a.u. | -6.949100 | ||
| NORM | 1.000000 | < R > | .586643 | < R2 > | .418198 | < 1/R > | 2.166739 | < 1/R**2 > | 6.403033 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.608215 | .34335702 |
| 2 | 2s | 3.977874 | -.78230036 |
| 3 | 3s | 5.561661 | -.27855703 |
| 4 | 4s | 21.150745 | .00188564 |
| 5 | 5s | 11.273149 | -.01799521 |
| 6 | 5s | 2.931734 | .01088537 |
| 7 | 3s | 38.051237 | .00004166 |
| ORB.ENERGY,a.u. | -7.150900 | ||
| NORM | 1.000000 | < R > | .653503 | < R2 > | .499579 | < 1/R > | 2.222558 | < 1/R**2 > | 19.992035 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.226395 | .93452160 |
| 2 | 1s | 16.793268 | .06841355 |
| 3 | 2s | 9.722945 | .02064756 |
| 4 | 3s | 12.306630 | -.02141741 |
| 5 | 4s | 54.974576 | -.00009158 |
| 6 | 5s | 24.097991 | .00134248 |
| 7 | 5s | 3.110077 | -.00092009 |
| 8 | 3s | 5.554882 | .00055189 |
| ORB.ENERGY,a.u. | -46.135000 |
| NORM | 1.000000 | < R > | .141903 | < R2 > | .027024 | < 1/R > | 10.651016 | < 1/R**2 > | 228.960797 |
Total Energy= -145.05871557 a.u.
Kinetic Energy= 145.03136335 a.u.
Potential Energy= -290.09007892 a.u.
Virial Ratio = -2.00018860