(1s 2 2s 2 2p 1 5p 1 ) 1 S Cl 11+
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 | 5.690805 | .29939107 |
| 2 | 3p | 2.808098 | -3.20410828 |
| 3 | 4p | 2.458724 | 9.18305504 |
| 4 | 5p | 2.451425 | -6.71899996 |
| 5 | 2p | 16.746894 | .00248224 |
| 6 | 5p | 9.130648 | .03749497 |
| 7 | 5p | 4.369851 | -.30509763 |
| 8 | 4p | 18.818976 | .00070199 |
| ORB.ENERGY,a.u. | -3.003400 | ||
| NORM | 1.000004 | < R > | 2.912449 | < R2 > | 9.542688 | < 1/R > | .465808 | < 1/R**2 > | .546444 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.305857 | 1.14561182 |
| 2 | 3p | 1.849146 | -.55342391 |
| 3 | 3p | 9.880057 | -.14043472 |
| 4 | 4p | 2.837353 | .24361477 |
| 5 | 5p | 3.037647 | .25087919 |
| 6 | 5p | 14.740356 | .01089279 |
| 7 | 4p | 28.119348 | -.00214084 |
| 8 | 5p | 1.991267 | .06734051 |
| 9 | 3p | 33.672341 | -.00051635 |
| ORB.ENERGY,a.u. | -23.593000 | ||
| NORM | 1.000000 | < R > | .347279 | < R2 > | .174710 | < 1/R > | 3.723747 | < 1/R**2 > | 18.725613 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.562641 | .38536599 |
| 2 | 2s | 6.574441 | -.81538148 |
| 3 | 3s | 9.424390 | -.28528983 |
| 4 | 4s | 31.677738 | .00124753 |
| 5 | 5s | 18.206691 | -.00897300 |
| 6 | 5s | 7.274424 | .01763501 |
| ORB.ENERGY,a.u. | -23.265000 | ||
| NORM | 1.000000 | < R > | .396126 | < R2 > | .183504 | < 1/R > | 3.712073 | < 1/R**2 > | 55.687008 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.193103 | .93681162 |
| 2 | 1s | 24.896971 | .06048885 |
| 3 | 2s | 14.833165 | .02007919 |
| 4 | 3s | 18.186895 | -.01490385 |
| 5 | 4s | 80.853914 | -.00006886 |
| 6 | 5s | 38.954638 | .00061353 |
| 7 | 4s | 6.294368 | .00002150 |
| ORB.ENERGY,a.u. | -121.620000 |
| NORM | 1.000000 | < R > | .090557 | < R2 > | .010980 | < 1/R > | 16.645779 | < 1/R**2 > | 557.448881 |
Total Energy= -362.46013712 a.u.
Kinetic Energy= 362.42351572 a.u.
Potential Energy= -724.88365283 a.u.
Virial Ratio = -2.00010105