(1s 2 5p 1 ) 2 P N 4+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
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 | 5p- electron | |
| 1 | 2p | .745479 | 5.83627604 |
| 2 | 3p | 1.229986 | -6.81032601 |
| 3 | 4p | .948921 | 8.12496447 |
| 4 | 5p | .981343 | -8.54627068 |
| 5 | 2p | 5.864306 | .01083485 |
| 6 | 5p | 6.719993 | .00274058 |
| 7 | 3p | 8.354420 | -.00102483 |
| 8 | 5p | .468327 | -.00182021 |
| ORB.ENERGY,a.u. | -.506380 | ||
| NORM | 1.000008 | < R > | 7.206184 | < R2 > | 58.481159 | < 1/R > | .203796 | < 1/R**2 > | .144586 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.261269 | .70799857 |
| 2 | 1s | 9.248222 | .23299044 |
| 3 | 2s | 7.098500 | .08408898 |
| 4 | 3s | 7.294673 | -.01412157 |
| 5 | 4s | 12.641725 | .00495534 |
| 6 | 5s | 51.929703 | -.00002145 |
| 7 | 5s | 6.962761 | -.00059230 |
| ORB.ENERGY,a.u. | -20.023000 |
| NORM | 1.000000 | < R > | .226520 | < R2 > | .068920 | < 1/R > | 6.686486 | < 1/R**2 > | 90.547320 |
Total Energy= -45.24247333 a.u.
Kinetic Energy= 45.24246515 a.u.
Potential Energy= -90.48493848 a.u.
Virial Ratio = -2.00000018