(1s 1 4p 1 ) 3 P Li +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3141.
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 | .323090 | .83413330 |
| 2 | 2p | .775779 | .68416449 |
| 3 | 3p | .545026 | -3.17854786 |
| 4 | 4p | .469360 | 2.90481229 |
| 5 | 5p | .453851 | -.68166958 |
| 6 | 2p | 2.409931 | .01921392 |
| 7 | 5p | 6.113055 | .00076615 |
| 8 | 4p | 4.399001 | -.00330537 |
| ORB.ENERGY,a.u. | -.128660 | ||
| NORM | 1.000001 | < R > | 11.204526 | < R2 > | 142.510752 | < 1/R > | .129781 | < 1/R**2 > | .047779 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 2.927711 | .75884186 |
| 2 | 1s | 3.102194 | .25458716 |
| 3 | 2s | 3.018801 | -.01448390 |
| 4 | 3s | 3.706248 | -.00073730 |
| 5 | 4s | 1.190800 | -.00018527 |
| ORB.ENERGY,a.u. | -4.347400 |
| NORM | 1.000000 | < R > | .500555 | < R2 > | .334190 | < 1/R > | 2.997696 | < 1/R**2 > | 17.977923 |
Total Energy= -4.62684550 a.u.
Kinetic Energy= 4.62811625 a.u.
Potential Energy= -9.25496174 a.u.
Virial Ratio = -1.99972543