(1s 2 2s 2 2p 4 4s 1 ) 2 P Cl 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2140.
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 | 4s- electron | |
| 1 | 1s | 13.828237 | .09806287 |
| 2 | 2s | 3.243470 | -1.46983217 |
| 3 | 3s | 3.267174 | 2.96587034 |
| 4 | 4s | 2.477283 | -1.94902220 |
| 5 | 5s | 4.830804 | -.17124805 |
| 6 | 4s | 15.144541 | -.01053654 |
| 7 | 5s | 35.598457 | -.00017550 |
| 8 | 5s | 1.716766 | .00259503 |
| 9 | 4s | 56.091560 | -.00007007 |
| ORB.ENERGY,a.u. | -3.112800 | ||
| NORM | 1.000001 | < R > | 2.184387 | < R2 > | 5.356554 | < 1/R > | .646037 | < 1/R**2 > | 3.241729 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.032194 | 1.13885886 |
| 2 | 3p | 6.807185 | -.21593796 |
| 3 | 2p | 12.845187 | .07405139 |
| 4 | 4p | 15.249200 | .01155075 |
| 5 | 5p | 42.615053 | -.00012661 |
| 6 | 5p | 6.273165 | -.00182244 |
| ORB.ENERGY,a.u. | -16.055000 | ||
| NORM | 1.000000 | < R > | .374419 | < R2 > | .171411 | < 1/R > | 3.415897 | < 1/R**2 > | 16.000172 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.718844 | .35634916 |
| 2 | 2s | 6.344382 | -.78361387 |
| 3 | 3s | 9.303078 | -.24320306 |
| 4 | 4s | 7.245802 | -.06434822 |
| 5 | 5s | 20.074162 | -.00837114 |
| 6 | 5s | 2.751926 | -.00554986 |
| 7 | 3s | 4.072788 | .00954835 |
| 8 | 3s | 59.439407 | -.00005969 |
| 9 | 4s | 118.761413 | .00000659 |
| 10 | 4s | 2.016633 | -.00091958 |
| ORB.ENERGY,a.u. | -16.930000 | ||
| NORM | 1.000000 | < R > | .420154 | < R2 > | .207693 | < 1/R > | 3.487328 | < 1/R**2 > | 49.646077 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.159822 | .92218574 |
| 2 | 1s | 23.499933 | .07414215 |
| 3 | 2s | 10.734893 | .01997031 |
| 4 | 3s | 12.879232 | -.01942940 |
| 5 | 4s | 15.205460 | .00867652 |
| 6 | 5s | 41.895026 | .00058273 |
| 7 | 4s | 85.667741 | -.00004040 |
| 8 | 5s | 2.687958 | .00259754 |
| 9 | 4s | 2.332417 | -.00228797 |
| ORB.ENERGY,a.u. | -112.130000 |
| NORM | 1.000000 | < R > | .091037 | < R2 > | .011123 | < 1/R > | 16.589407 | < 1/R**2 > | 554.516836 |
Total Energy= -420.46272472 a.u.
Kinetic Energy= 420.44361968 a.u.
Potential Energy= -840.90634440 a.u.
Virial Ratio = -2.00004544