(1s 2 2s 2 2p 1 4d 1 ) 1 P Ar 12+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1142.
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 | 4d- electron | |
| 1 | 3d | 3.640592 | 1.44589324 |
| 2 | 4d | 3.218280 | -1.94753082 |
| 3 | 3d | 8.489768 | .01339320 |
| 4 | 4d | 1.961333 | -.00226994 |
| 5 | 5d | 17.544544 | .00303706 |
| 6 | 5d | 2.661826 | .01158819 |
| 7 | 3d | 19.689016 | .00070629 |
| 8 | 4d | 21.727273 | .00059676 |
| ORB.ENERGY,a.u. | -5.323600 | ||
| NORM | 1.000000 | < R > | 1.596777 | < R2 > | 2.920125 | < 1/R > | .828909 | < 1/R**2 > | 1.119696 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.630239 | 1.08341878 |
| 2 | 3p | 9.091404 | -.09589018 |
| 3 | 2p | 18.827876 | .01093796 |
| 4 | 5p | 23.099102 | .00214686 |
| 5 | 5p | 7.764574 | .00156854 |
| 6 | 4p | 3.872466 | .00027542 |
| ORB.ENERGY,a.u. | -26.816000 | ||
| NORM | 1.000000 | < R > | .320029 | < R2 > | .123804 | < 1/R > | 3.942148 | < 1/R**2 > | 20.973642 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 15.383932 | .38983931 |
| 2 | 2s | 7.016617 | -.81720830 |
| 3 | 3s | 10.041352 | -.28689045 |
| 4 | 4s | 33.351079 | .00110576 |
| 5 | 5s | 19.648822 | -.00845617 |
| 6 | 5s | 7.780438 | .01778975 |
| ORB.ENERGY,a.u. | -26.841000 | ||
| NORM | 1.000000 | < R > | .371789 | < R2 > | .161634 | < 1/R > | 3.959506 | < 1/R**2 > | 63.337561 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.206606 | .93972792 |
| 2 | 1s | 26.431011 | .05678953 |
| 3 | 2s | 15.862710 | .01998871 |
| 4 | 3s | 19.382562 | -.01406860 |
| 5 | 4s | 86.483365 | -.00006230 |
| 6 | 5s | 41.294545 | .00061094 |
| 7 | 4s | 8.478600 | .00004282 |
| ORB.ENERGY,a.u. | -137.760000 |
| NORM | 1.000000 | < R > | .085400 | < R2 > | .009763 | < 1/R > | 17.645940 | < 1/R**2 > | 626.236552 |
Total Energy= -410.61410105 a.u.
Kinetic Energy= 410.53362752 a.u.
Potential Energy= -821.14772857 a.u.
Virial Ratio = -2.00019602