(1s 2 4p 1 ) 2 P Na 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2141.
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 | 4p- electron | |
| 1 | 2p | 4.533380 | .45786479 |
| 2 | 3p | 2.161534 | -1.15645881 |
| 3 | 5p | 2.379122 | 1.78296820 |
| 4 | 4p | 3.440326 | -.56087762 |
| 5 | 5p | 5.367933 | .05657364 |
| 6 | 4p | 11.824581 | -.01143061 |
| 7 | 5p | 2.890698 | .19497953 |
| 8 | 5p | 25.204447 | -.00034180 |
| 9 | 3p | 16.435858 | -.00218212 |
| 10 | 4p | 1.008681 | .00067510 |
| ORB.ENERGY,a.u. | -2.559400 | ||
| NORM | .999999 | < R > | 2.527475 | < R2 > | 7.247541 | < 1/R > | .571125 | < 1/R**2 > | .890807 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.461174 | .93835989 |
| 2 | 1s | 17.357326 | .05015298 |
| 3 | 2s | 13.131754 | .01646673 |
| 4 | 3s | 11.303926 | .00329562 |
| 5 | 4s | 18.425402 | -.00193788 |
| 6 | 5s | 22.732958 | .00061325 |
| 7 | 3s | 27.801185 | -.00087853 |
| ORB.ENERGY,a.u. | -53.209000 |
| NORM | 1.000000 | < R > | .141236 | < R2 > | .026719 | < 1/R > | 10.685034 | < 1/R**2 > | 230.142909 |
Total Energy= -116.79418332 a.u.
Kinetic Energy= 116.79418217 a.u.
Potential Energy= -233.58836549 a.u.
Virial Ratio = -2.00000001