(1s 1 4p 1 ) 3 P F 7+
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 | .952430 | .75523165 |
| 2 | 2p | 2.610646 | 1.11138361 |
| 3 | 3p | 2.127580 | -3.86201271 |
| 4 | 4p | 1.996653 | 2.93594324 |
| 5 | 5p | 1.520283 | -.23471138 |
| 6 | 2p | 8.958280 | .00561549 |
| 7 | 3p | 3.728150 | -.01308771 |
| 8 | 4p | 1.045652 | -.10819598 |
| 9 | 5p | 42.000616 | .00002516 |
| ORB.ENERGY,a.u. | -2.064000 | ||
| NORM | 1.000000 | < R > | 2.846293 | < R2 > | 9.190085 | < 1/R > | .506441 | < 1/R**2 > | .696269 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 8.851745 | .75719995 |
| 2 | 1s | 9.103000 | .25662518 |
| 3 | 2s | 9.012528 | -.01586330 |
| 4 | 3s | 5.297413 | -.00030195 |
| 5 | 4s | 9.247527 | .00027513 |
| 6 | 5s | 28.521858 | -.00001510 |
| ORB.ENERGY,a.u. | -40.033000 |
| NORM | 1.000000 | < R > | .166757 | < R2 > | .037081 | < 1/R > | 8.996358 | < 1/R**2 > | 161.892681 |
Total Energy= -42.51269162 a.u.
Kinetic Energy= 42.51947202 a.u.
Potential Energy= -85.03216364 a.u.
Virial Ratio = -1.99984053