(1s 2 2s 2 2p 5 5s 1 ) 1 P Na +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1150.
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 | 5s- electron | |
| 1 | 1s | 9.842835 | .02210098 |
| 2 | 2s | 2.983651 | -.09099992 |
| 3 | 3s | 1.129889 | .55383745 |
| 4 | 4s | .659007 | -1.64718265 |
| 5 | 5s | .519496 | 1.81029894 |
| 6 | 5s | 9.128150 | -.00849878 |
| 7 | 4s | 11.952129 | -.00489569 |
| 8 | 5s | 31.630095 | -.00014688 |
| 9 | 4s | 47.042468 | -.00003507 |
| ORB.ENERGY,a.u. | -.124380 | ||
| NORM | 1.000001 | < R > | 12.102926 | < R2 > | 164.274941 | < 1/R > | .113425 | < 1/R**2 > | .105204 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 2.844574 | 1.40736067 |
| 2 | 3p | 3.454691 | -.51119142 |
| 3 | 2p | 7.772871 | .09962159 |
| 4 | 4p | 8.817804 | .02721338 |
| 5 | 5p | 2.168522 | .02851075 |
| 6 | 4p | 1.921228 | -.03135890 |
| 7 | 5p | 25.973350 | -.00026164 |
| 8 | 4p | 16.632959 | .00056034 |
| ORB.ENERGY,a.u. | -2.446400 | ||
| NORM | 1.000000 | < R > | .738785 | < R2 > | .689511 | < 1/R > | 1.796598 | < 1/R**2 > | 4.608527 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 10.156999 | .27360184 |
| 2 | 2s | 3.073539 | -.77794773 |
| 3 | 3s | 6.418223 | -.23517009 |
| 4 | 4s | 5.499385 | -.05419717 |
| 5 | 5s | 12.643174 | -.01044523 |
| 6 | 5s | 4.064507 | .02036779 |
| 7 | 4s | .645573 | -.01266061 |
| 8 | 3s | .438148 | .01308807 |
| 9 | 3s | 41.003949 | -.00008087 |
| 10 | 4s | 75.968222 | .00001389 |
| ORB.ENERGY,a.u. | -2.975600 | ||
| NORM | 1.000000 | < R > | .752748 | < R2 > | .678521 | < 1/R > | 1.927700 | < 1/R**2 > | 15.325657 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.229990 | .91335577 |
| 2 | 1s | 15.495173 | .08641011 |
| 3 | 2s | 5.419537 | .01489437 |
| 4 | 3s | 7.105545 | -.01764469 |
| 5 | 4s | 9.175599 | .01094214 |
| 6 | 5s | 25.967821 | .00104762 |
| 7 | 4s | 58.248303 | -.00005699 |
| ORB.ENERGY,a.u. | -39.982000 |
| NORM | 1.000000 | < R > | .142773 | < R2 > | .027438 | < 1/R > | 10.611052 | < 1/R**2 > | 227.651472 |
Total Energy= -160.12277466 a.u.
Kinetic Energy= 160.12171682 a.u.
Potential Energy= -320.24449148 a.u.
Virial Ratio = -2.00000661