(1s 2 2s 2 2p 2 3s 1 ) 4 P P 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4130.
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 | 11.903796 | .19215146 |
| 2 | 2s | 4.518271 | -.97613490 |
| 3 | 3s | 3.425886 | 1.51345639 |
| 4 | 4s | 10.093990 | -.03361471 |
| 5 | 5s | 17.264454 | -.00598457 |
| 6 | 4s | 66.885863 | -.00001895 |
| 7 | 5s | 3.590181 | .00794395 |
| ORB.ENERGY,a.u. | -5.701900 | ||
| NORM | 1.000000 | < R > | 1.197817 | < R2 > | 1.628505 | < 1/R > | 1.202100 | < 1/R**2 > | 8.795333 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.701581 | 1.18553869 |
| 2 | 3p | 6.545550 | -.21483878 |
| 3 | 2p | 14.029687 | .02363664 |
| 4 | 4p | 15.502263 | .00484789 |
| 5 | 5p | 32.843165 | -.00027303 |
| 6 | 5p | 4.257412 | .00079740 |
| ORB.ENERGY,a.u. | -14.654000 | ||
| NORM | 1.000000 | < R > | .410999 | < R2 > | .205410 | < 1/R > | 3.090846 | < 1/R**2 > | 12.999500 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.577987 | .42829299 |
| 2 | 2s | 6.612188 | -.89004872 |
| 3 | 3s | 6.138537 | -.29801763 |
| 4 | 4s | 25.777002 | .00236204 |
| 5 | 3s | 12.897227 | .03031992 |
| 6 | 5s | 4.497296 | -.01020624 |
| 7 | 4s | 2.469473 | -.00041813 |
| 8 | 3s | 42.730432 | .00003504 |
| ORB.ENERGY,a.u. | -14.334000 | ||
| NORM | 1.000000 | < R > | .470218 | < R2 > | .260026 | < 1/R > | 3.117840 | < 1/R**2 > | 39.529373 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.116253 | .92203160 |
| 2 | 1s | 21.401730 | .07770223 |
| 3 | 2s | 12.287501 | .01917445 |
| 4 | 3s | 15.830400 | -.01588219 |
| 5 | 5s | 35.361533 | .00077446 |
| 6 | 4s | 76.836681 | -.00005252 |
| 7 | 5s | 4.789706 | .00052149 |
| ORB.ENERGY,a.u. | -89.095000 |
| NORM | 1.000000 | < R > | .103183 | < R2 > | .014275 | < 1/R > | 14.628415 | < 1/R**2 > | 431.093454 |
Total Energy= -297.35054395 a.u.
Kinetic Energy= 297.38382149 a.u.
Potential Energy= -594.73436544 a.u.
Virial Ratio = -1.99988810