(1s 2 2s 1 3p 1 ) 3 P Ar 14+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3131.
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 | 5.908690 | 1.07363432 |
| 2 | 3p | 5.063261 | -1.68069506 |
| 3 | 2p | 14.016300 | .02932580 |
| 4 | 4p | 15.140906 | .01319000 |
| 5 | 3p | 53.320233 | .00002283 |
| 6 | 5p | 3.083731 | .00011104 |
| 7 | 4p | 40.342505 | -.00000505 |
| ORB.ENERGY,a.u. | -12.971000 | ||
| NORM | 1.000000 | < R > | .803669 | < R2 > | .744199 | < 1/R > | 1.732748 | < 1/R**2 > | 6.123347 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.859673 | .42672973 |
| 2 | 2s | 7.675491 | -.81457541 |
| 3 | 3s | 9.812577 | -.29719766 |
| 4 | 5s | 16.396636 | -.01808379 |
| 5 | 4s | 32.231677 | .00380448 |
| 6 | 5s | 42.837660 | -.00077046 |
| 7 | 4s | 4.329930 | -.00019308 |
| 8 | 3s | 68.160592 | .00003351 |
| ORB.ENERGY,a.u. | -32.342000 | ||
| NORM | 1.000000 | < R > | .360314 | < R2 > | .151549 | < 1/R > | 4.105909 | < 1/R**2 > | 67.935297 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.360247 | .93816136 |
| 2 | 1s | 27.352309 | .04908869 |
| 3 | 2s | 21.962293 | .01683951 |
| 4 | 3s | 12.901968 | .00109947 |
| 5 | 4s | 71.159233 | -.00040887 |
| 6 | 5s | 94.505427 | .00015005 |
| 7 | 5s | 23.121374 | .00021162 |
| ORB.ENERGY,a.u. | -144.680000 |
| NORM | 1.000000 | < R > | .085240 | < R2 > | .009720 | < 1/R > | 17.668864 | < 1/R**2 > | 627.552704 |
Total Energy= -359.37456192 a.u.
Kinetic Energy= 359.39501990 a.u.
Potential Energy= -718.76958182 a.u.
Virial Ratio = -1.99994308