(1s 2 3p 1 ) 2 P S 13+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2131.
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 | 3p- electron | |
| 1 | 2p | 6.343352 | .84983478 |
| 2 | 3p | 4.575643 | -1.57589378 |
| 3 | 4p | 7.213012 | .18733330 |
| 4 | 5p | 12.859473 | .01666482 |
| 5 | 4p | 29.221786 | -.00285184 |
| 6 | 5p | 38.020625 | .00087000 |
| 7 | 5p | 4.336778 | .00843842 |
| 8 | 3p | 61.880218 | -.00004019 |
| ORB.ENERGY,a.u. | -11.013000 | ||
| NORM | 1.000000 | < R > | .883290 | < R2 > | .899245 | < 1/R > | 1.577971 | < 1/R**2 > | 5.046023 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 15.401973 | .93703325 |
| 2 | 1s | 23.912207 | .05137379 |
| 3 | 2s | 18.060285 | .01706087 |
| 4 | 3s | 16.564285 | .00105772 |
| 5 | 4s | 23.004273 | -.00161834 |
| 6 | 5s | 29.539297 | .00032401 |
| 7 | 3s | 40.349204 | -.00057243 |
| 8 | 5s | 8.004991 | -.00008309 |
| ORB.ENERGY,a.u. | -116.840000 |
| NORM | 1.000000 | < R > | .096063 | < R2 > | .012344 | < 1/R > | 15.680781 | < 1/R**2 > | 494.462425 |
Total Energy= -257.10830048 a.u.
Kinetic Energy= 257.10830014 a.u.
Potential Energy= -514.21660062 a.u.
Virial Ratio = -2.00000000