(1s 2 2s 2 2p 1 5p 1 ) 1 S Si 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1051.
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 | 4.995274 | .22463811 |
| 2 | 3p | 2.146080 | -2.80280853 |
| 3 | 4p | 1.871297 | 8.28176993 |
| 4 | 5p | 1.850991 | -6.13516706 |
| 5 | 2p | 16.776481 | .00096529 |
| 6 | 5p | 7.255106 | .05144513 |
| 7 | 5p | 3.420212 | -.31705800 |
| ORB.ENERGY,a.u. | -1.707600 | ||
| NORM | 1.000003 | < R > | 3.840283 | < R2 > | 16.585323 | < 1/R > | .351786 | < 1/R**2 > | .306844 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.804984 | 1.17652137 |
| 2 | 3p | 1.327989 | -.58647013 |
| 3 | 3p | 7.881752 | -.17732259 |
| 4 | 4p | 2.129095 | .22852086 |
| 5 | 5p | 2.315337 | .24039895 |
| 6 | 5p | 11.881817 | .01428671 |
| 7 | 4p | 22.510824 | -.00252996 |
| 8 | 5p | 1.517953 | .13119065 |
| 9 | 3p | 25.630542 | -.00080627 |
| 10 | 4p | .994510 | .00389594 |
| ORB.ENERGY,a.u. | -14.361000 | ||
| NORM | 1.000000 | < R > | .437482 | < R2 > | .279727 | < 1/R > | 2.961855 | < 1/R**2 > | 11.882135 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.151769 | .36493881 |
| 2 | 2s | 5.189688 | -.80589542 |
| 3 | 3s | 7.620604 | -.28121520 |
| 4 | 4s | 26.345997 | .00140645 |
| 5 | 5s | 14.792898 | -.01163718 |
| 6 | 5s | 5.788157 | .01959477 |
| ORB.ENERGY,a.u. | -14.065000 | ||
| NORM | 1.000000 | < R > | .494279 | < R2 > | .285972 | < 1/R > | 2.961684 | < 1/R**2 > | 35.495051 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 13.162216 | .92573792 |
| 2 | 1s | 20.229488 | .07470221 |
| 3 | 2s | 11.719234 | .01892049 |
| 4 | 3s | 14.617427 | -.01690580 |
| 5 | 4s | 69.179566 | -.00006917 |
| 6 | 5s | 32.292995 | .00079976 |
| 7 | 4s | 3.896308 | .00001742 |
| ORB.ENERGY,a.u. | -79.321000 |
| NORM | 1.000000 | < R > | .110555 | < R2 > | .016379 | < 1/R > | 13.648560 | < 1/R**2 > | 375.237518 |
Total Energy= -240.29035822 a.u.
Kinetic Energy= 240.26427615 a.u.
Potential Energy= -480.55463437 a.u.
Virial Ratio = -2.00010856