(1s 2 2s 2 2p 2 3p 1 ) 2 P Cl 10+
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 | 4.941566 | .78718563 |
| 2 | 3p | 3.862790 | -1.44078309 |
| 3 | 2p | 12.944494 | .03438136 |
| 4 | 4p | 8.144127 | -.08481339 |
| 5 | 5p | 9.329160 | .02953266 |
| 6 | 5p | 22.638214 | .00160847 |
| ORB.ENERGY,a.u. | -7.457800 | ||
| NORM | 1.000000 | < R > | 1.042128 | < R2 > | 1.224611 | < 1/R > | 1.236769 | < 1/R**2 > | 2.963630 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.763376 | 1.36700782 |
| 2 | 3p | 8.617211 | -.38936244 |
| 3 | 2p | 4.179347 | -.09341772 |
| 4 | 4p | 10.723720 | .09639355 |
| 5 | 5p | 21.133052 | .00418648 |
| 6 | 5p | 4.300531 | -.01645376 |
| 7 | 3p | 10.797750 | .00093066 |
| 8 | 4p | 3.281851 | .00164858 |
| 9 | 4p | 45.509163 | -.00005472 |
| ORB.ENERGY,a.u. | -64.996000 | ||
| NORM | 1.000000 | < R > | .344042 | < R2 > | .142200 | < 1/R > | 3.652862 | < 1/R**2 > | 17.992263 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.353171 | .42835990 |
| 2 | 2s | 7.460783 | -.86842589 |
| 3 | 3s | 7.595196 | -.28611224 |
| 4 | 4s | 28.851321 | .00196512 |
| 5 | 3s | 15.560092 | .01715586 |
| 6 | 5s | 7.292378 | -.01972157 |
| ORB.ENERGY,a.u. | -20.297000 | ||
| NORM | 1.000000 | < R > | .405375 | < R2 > | .192619 | < 1/R > | 3.622446 | < 1/R**2 > | 53.249121 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.057061 | .92201193 |
| 2 | 1s | 24.205129 | .07678706 |
| 3 | 2s | 15.031507 | .01931130 |
| 4 | 3s | 18.651583 | -.01559379 |
| 5 | 5s | 40.238719 | .00078467 |
| 6 | 4s | 92.643767 | -.00003691 |
| 7 | 5s | 14.136659 | .00036227 |
| ORB.ENERGY,a.u. | -117.740000 |
| NORM | 1.000000 | < R > | .090761 | < R2 > | .011040 | < 1/R > | 16.621379 | < 1/R**2 > | 556.173516 |
Total Energy= -388.75139718 a.u.
Kinetic Energy= 388.61245726 a.u.
Potential Energy= -777.36385444 a.u.
Virial Ratio = -2.00035753