(1s 2 2s 1 4p 1 ) 3 P Ar 14+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3141.
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 | 4p- electron | |
| 1 | 2p | 7.278677 | .52047757 |
| 2 | 3p | 4.467027 | -1.02407382 |
| 3 | 5p | 4.015283 | 1.53734372 |
| 4 | 4p | 5.986775 | -.38814401 |
| 5 | 5p | 8.732789 | .08068129 |
| 6 | 4p | 19.005291 | -.00959546 |
| 7 | 5p | 37.565015 | -.00136897 |
| 8 | 4p | 48.054335 | -.00066515 |
| 9 | 5p | 2.824559 | .00542526 |
| 10 | 3p | 66.257333 | -.00008081 |
| ORB.ENERGY,a.u. | -7.221600 | ||
| NORM | 1.000000 | < R > | 1.494884 | < R2 > | 2.534156 | < 1/R > | .963382 | < 1/R**2 > | 2.538454 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.335287 | .45183361 |
| 2 | 2s | 8.160951 | -.81895463 |
| 3 | 3s | 9.014313 | -.31422569 |
| 4 | 5s | 16.181499 | -.02624158 |
| 5 | 4s | 34.320557 | .00414776 |
| 6 | 5s | 46.351989 | -.00109240 |
| 7 | 5s | 4.032960 | .00279395 |
| 8 | 4s | 3.481726 | -.00265464 |
| 9 | 3s | 88.719594 | .00002693 |
| ORB.ENERGY,a.u. | -32.902000 | ||
| NORM | 1.000000 | < R > | .359048 | < R2 > | .150356 | < 1/R > | 4.119825 | < 1/R**2 > | 68.347609 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.358661 | .93849606 |
| 2 | 1s | 27.374431 | .04901846 |
| 3 | 2s | 21.949774 | .01687500 |
| 4 | 3s | 9.526536 | .00044219 |
| 5 | 4s | 70.492258 | -.00042465 |
| 6 | 5s | 93.495660 | .00015666 |
| 7 | 5s | 19.721798 | .00052238 |
| ORB.ENERGY,a.u. | -144.680000 |
| NORM | 1.000000 | < R > | .085217 | < R2 > | .009714 | < 1/R > | 17.672244 | < 1/R**2 > | 627.745359 |
Total Energy= -353.65020155 a.u.
Kinetic Energy= 353.65719153 a.u.
Potential Energy= -707.30739308 a.u.
Virial Ratio = -1.99998024