(1s 2 2s 2 2p 2 4d 1 ) 4 F Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4342.
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 | 3.641121 | 1.15218131 |
| 2 | 4d | 2.983187 | -1.72440614 |
| 3 | 3d | 7.368087 | .06409895 |
| 4 | 4d | 8.822819 | -.01518731 |
| 5 | 5d | 2.830882 | .05433383 |
| 6 | 5d | 27.508104 | -.00039445 |
| 7 | 4d | 45.648976 | -.00003589 |
| ORB.ENERGY,a.u. | -4.668600 | ||
| NORM | 1.000000 | < R > | 1.677551 | < R2 > | 3.222402 | < 1/R > | .791486 | < 1/R**2 > | 1.036127 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.150373 | 1.12102742 |
| 2 | 3p | 7.968702 | -.15640610 |
| 3 | 2p | 16.791448 | .02676629 |
| 4 | 4p | 19.593245 | .01356337 |
| 5 | 5p | 25.582438 | -.00281332 |
| 6 | 5p | 6.222303 | -.00144352 |
| 7 | 3p | 40.864947 | .00025923 |
| 8 | 3p | 2.745211 | -.00041433 |
| ORB.ENERGY,a.u. | -24.450000 | ||
| NORM | 1.000000 | < R > | .328730 | < R2 > | .130955 | < 1/R > | 3.850233 | < 1/R**2 > | 20.086737 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.053884 | .43773077 |
| 2 | 2s | 7.995852 | -.87199001 |
| 3 | 3s | 8.177484 | -.28713435 |
| 4 | 4s | 30.507912 | .00191154 |
| 5 | 3s | 16.555811 | .01634590 |
| 6 | 5s | 8.253895 | -.02056991 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .378757 | < R2 > | .168007 | < 1/R > | 3.881536 | < 1/R**2 > | 61.072810 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.068397 | .92683115 |
| 2 | 1s | 25.713019 | .07171348 |
| 3 | 2s | 15.771722 | .01936933 |
| 4 | 3s | 19.684155 | -.01555072 |
| 5 | 5s | 42.467795 | .00077902 |
| 6 | 4s | 99.595131 | -.00003430 |
| 7 | 5s | 12.639427 | .00023293 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085562 | < R2 > | .009807 | < 1/R > | 17.624259 | < 1/R**2 > | 625.035945 |
Total Energy= -435.02741230 a.u.
Kinetic Energy= 435.06512990 a.u.
Potential Energy= -870.09254220 a.u.
Virial Ratio = -1.99991331