(1s 2 2s 2 2p 1 4p 1 ) 1 P P 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1141.
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 | 6.734783 | .31209637 |
| 2 | 3p | 2.805611 | -.72843916 |
| 3 | 5p | 2.912672 | 1.26914025 |
| 4 | 4p | 4.158535 | -.47819305 |
| 5 | 5p | 8.667954 | .03120526 |
| 6 | 4p | 20.813955 | -.00278508 |
| 7 | 5p | 2.567539 | .32139708 |
| 8 | 5p | 46.137583 | -.00028071 |
| 9 | 4p | 69.995641 | -.00005892 |
| ORB.ENERGY,a.u. | -3.411000 | ||
| NORM | 1.000000 | < R > | 2.112208 | < R2 > | 5.047887 | < 1/R > | .672173 | < 1/R**2 > | 1.254491 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.164548 | 1.08158229 |
| 2 | 3p | 7.554224 | -.09717439 |
| 3 | 2p | 14.887969 | .01477505 |
| 4 | 5p | 18.127674 | .00297272 |
| 5 | 4p | 33.030387 | -.00014905 |
| 6 | 5p | 5.849465 | .00287350 |
| 7 | 4p | 5.523807 | -.00014196 |
| ORB.ENERGY,a.u. | -17.033000 | ||
| NORM | 1.000000 | < R > | .396615 | < R2 > | .190439 | < 1/R > | 3.187479 | < 1/R**2 > | 13.750851 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.939707 | .37289260 |
| 2 | 2s | 5.668863 | -.80854152 |
| 3 | 3s | 8.203467 | -.28208067 |
| 4 | 4s | 27.823207 | .00150563 |
| 5 | 5s | 15.844348 | -.01009337 |
| 6 | 5s | 6.219092 | .01522326 |
| 7 | 4s | 2.739597 | .00026496 |
| ORB.ENERGY,a.u. | -16.877000 | ||
| NORM | 1.000000 | < R > | .456971 | < R2 > | .244368 | < 1/R > | 3.208773 | < 1/R**2 > | 41.651881 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.162768 | .93082490 |
| 2 | 1s | 21.861639 | .06893158 |
| 3 | 2s | 12.883292 | .01923591 |
| 4 | 3s | 15.975636 | -.01666830 |
| 5 | 4s | 73.943126 | -.00006788 |
| 6 | 5s | 34.187047 | .00077224 |
| 7 | 4s | 4.163650 | .00001437 |
| ORB.ENERGY,a.u. | -92.406000 |
| NORM | 1.000000 | < R > | .102985 | < R2 > | .014208 | < 1/R > | 14.646640 | < 1/R**2 > | 431.933946 |
Total Energy= -279.46825973 a.u.
Kinetic Energy= 279.50397668 a.u.
Potential Energy= -558.97223641 a.u.
Virial Ratio = -1.99987221