(1s 2 2s 2 2p 2 5d 1 ) 2 P Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2152.
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 | 5d- electron | |
| 1 | 3d | 3.056583 | 1.53420662 |
| 2 | 4d | 2.617025 | -4.24067787 |
| 3 | 5d | 2.393581 | 3.37921685 |
| 4 | 3d | 6.972147 | .04664307 |
| 5 | 5d | 10.727815 | -.00791063 |
| 6 | 4d | 42.005420 | .00010970 |
| 7 | 5d | 1.831492 | -.01327398 |
| 8 | 5d | 57.357772 | -.00004952 |
| ORB.ENERGY,a.u. | -2.950600 | ||
| NORM | 1.000000 | < R > | 2.800536 | < R2 > | 8.903960 | < 1/R > | .497452 | < 1/R**2 > | .513348 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.219934 | 1.14315063 |
| 2 | 3p | 8.317477 | -.16612748 |
| 3 | 2p | 16.860416 | .02090655 |
| 4 | 4p | 18.720994 | .00430610 |
| 5 | 5p | 40.323512 | -.00023472 |
| 6 | 5p | 7.190595 | -.00527860 |
| 7 | 4p | 5.618391 | .00172974 |
| ORB.ENERGY,a.u. | -24.712000 | ||
| NORM | 1.000000 | < R > | .328333 | < R2 > | .130627 | < 1/R > | 3.854209 | < 1/R**2 > | 20.123620 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.075640 | .43702807 |
| 2 | 2s | 7.979546 | -.87227817 |
| 3 | 3s | 8.174054 | -.28716482 |
| 4 | 4s | 30.423492 | .00191711 |
| 5 | 3s | 16.696451 | .01549185 |
| 6 | 5s | 8.157958 | -.01774417 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .378497 | < R2 > | .167759 | < 1/R > | 3.884289 | < 1/R**2 > | 61.153680 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.068188 | .92683692 |
| 2 | 1s | 25.714726 | .07171004 |
| 3 | 2s | 15.774855 | .01936634 |
| 4 | 3s | 19.685488 | -.01555029 |
| 5 | 5s | 42.457156 | .00077889 |
| 6 | 4s | 99.605494 | -.00003404 |
| 7 | 5s | 12.684185 | .00022971 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085562 | < R2 > | .009807 | < 1/R > | 17.624186 | < 1/R**2 > | 625.031478 |
Total Energy= -433.34525053 a.u.
Kinetic Energy= 433.34747280 a.u.
Potential Energy= -866.69272333 a.u.
Virial Ratio = -1.99999487