(1s 2 3s 1 ) 2 S Ar 15+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2030.
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 | 3s- electron | |
| 1 | 1s | 12.256140 | .30735372 |
| 2 | 2s | 5.740294 | -1.65537536 |
| 3 | 3s | 5.347802 | 2.25245143 |
| 4 | 4s | 9.289002 | -.18292555 |
| 5 | 5s | 15.935333 | -.02707394 |
| 6 | 5s | 4.040021 | -.00619785 |
| 7 | 4s | 30.069032 | .00050192 |
| 8 | 5s | 23.955350 | -.00318678 |
| 9 | 4s | 3.238256 | .00358700 |
| 10 | 2s | 31.997139 | -.00009228 |
| ORB.ENERGY,a.u. | -14.723000 | ||
| NORM | 1.000000 | < R > | .818826 | < R2 > | .761412 | < 1/R > | 1.812773 | < 1/R**2 > | 19.795278 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.377665 | .93942371 |
| 2 | 1s | 27.333787 | .04822477 |
| 3 | 2s | 21.776633 | .01718624 |
| 4 | 3s | 18.513275 | .00060773 |
| 5 | 4s | 28.768085 | -.00086431 |
| 6 | 5s | 38.293897 | .00031309 |
| 7 | 3s | 46.494586 | -.00045505 |
| 8 | 5s | 5.850737 | -.00005755 |
| ORB.ENERGY,a.u. | -149.730000 |
| NORM | 1.000000 | < R > | .085129 | < R2 > | .009689 | < 1/R > | 17.684477 | < 1/R**2 > | 628.451263 |
Total Energy= -327.52891144 a.u.
Kinetic Energy= 327.52890922 a.u.
Potential Energy= -655.05782066 a.u.
Virial Ratio = -2.00000001