(1s 2 5p 1 ) 2 P P 12+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
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 | 5p- electron | |
| 1 | 2p | 1.823224 | 7.01262004 |
| 2 | 3p | 3.164414 | -7.33573501 |
| 3 | 4p | 2.362757 | 9.12564358 |
| 4 | 5p | 2.516602 | -10.29761331 |
| 5 | 2p | 16.944013 | .00268968 |
| 6 | 5p | 6.349209 | .01979701 |
| 7 | 5p | 1.972983 | -.17272136 |
| ORB.ENERGY,a.u. | -3.404600 | ||
| NORM | .999992 | < R > | 2.789557 | < R2 > | 8.762288 | < 1/R > | .524601 | < 1/R**2 > | .934748 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.430059 | .93851797 |
| 2 | 1s | 22.826914 | .04913793 |
| 3 | 2s | 17.461529 | .01707789 |
| 4 | 3s | 13.719264 | .00073212 |
| 5 | 4s | 47.318618 | -.00066962 |
| 6 | 5s | 56.083832 | .00022477 |
| 7 | 3s | 71.872033 | -.00004797 |
| ORB.ENERGY,a.u. | -102.950000 |
| NORM | 1.000000 | < R > | .102582 | < R2 > | .014077 | < 1/R > | 14.686155 | < 1/R**2 > | 433.822550 |
Total Energy= -219.13738683 a.u.
Kinetic Energy= 219.13742147 a.u.
Potential Energy= -438.27480830 a.u.
Virial Ratio = -1.99999984