(1s 2 2s 2 2p 2 4s 1 ) 4 P Ne 3+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4140.
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 | 4s- electron | |
| 1 | 1s | 8.768693 | .07288153 |
| 2 | 2s | 1.769744 | -.98937662 |
| 3 | 3s | 1.673963 | 2.28871289 |
| 4 | 4s | 1.178597 | -1.65657050 |
| 5 | 5s | 2.407336 | -.26670125 |
| 6 | 4s | 7.310134 | -.03906018 |
| 7 | 5s | 14.116336 | -.00413232 |
| 8 | 4s | 21.217448 | -.00097685 |
| 9 | 5s | 62.753704 | -.00002632 |
| ORB.ENERGY,a.u. | -.679690 | ||
| NORM | 1.000002 | < R > | 4.446953 | < R2 > | 22.215870 | < 1/R > | .316510 | < 1/R**2 > | .797534 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.234164 | .83003077 |
| 2 | 2p | 5.365065 | .19816066 |
| 3 | 2p | 11.450093 | .00819006 |
| 4 | 3p | 2.214380 | .01382414 |
| 5 | 4p | 3.689821 | -.02089579 |
| 6 | 5p | 23.579634 | -.00025104 |
| 7 | 5p | 2.221158 | -.00361868 |
| 8 | 4p | 90.074852 | .00000172 |
| ORB.ENERGY,a.u. | -4.336100 | ||
| NORM | 1.000000 | < R > | .701093 | < R2 > | .602748 | < 1/R > | 1.831638 | < 1/R**2 > | 4.628886 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.216847 | .34971251 |
| 2 | 2s | 3.934260 | -.83757039 |
| 3 | 3s | 3.671533 | -.27847745 |
| 4 | 4s | 11.768077 | .01284499 |
| 5 | 3s | 12.986093 | .01047095 |
| 6 | 5s | 3.346379 | -.01366820 |
| 7 | 4s | 1.037165 | .01513020 |
| 8 | 5s | 41.602034 | -.00008341 |
| 9 | 3s | .839698 | -.00967712 |
| 10 | 2s | 54.563398 | .00001414 |
| ORB.ENERGY,a.u. | -3.873300 | ||
| NORM | 1.000000 | < R > | .768260 | < R2 > | .696540 | < 1/R > | 1.883743 | < 1/R**2 > | 14.451988 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 7.823700 | .01060098 |
| 2 | 1s | 8.707808 | .61074490 |
| 3 | 1s | 13.272569 | .30019232 |
| 4 | 2s | 10.353550 | .13387482 |
| 5 | 3s | 10.868870 | -.04301149 |
| 6 | 4s | 18.539279 | .00323498 |
| 7 | 5s | 64.191236 | -.00002675 |
| 8 | 5s | 7.044364 | .00054346 |
| 9 | 4s | 1.201041 | -.00146140 |
| 10 | 3s | 1.070129 | .00130214 |
| ORB.ENERGY,a.u. | -35.222000 |
| NORM | 1.000000 | < R > | .156990 | < R2 > | .033126 | < 1/R > | 9.641353 | < 1/R**2 > | 187.880729 |
Total Energy= -121.21805668 a.u.
Kinetic Energy= 121.22279485 a.u.
Potential Energy= -242.44085153 a.u.
Virial Ratio = -1.99996091