(1s 2 2s 2 2p 1 4s 1 ) 1 P Mg 6+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1140.
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 | 4s- electron | |
| 1 | 1s | 9.869440 | .10187123 |
| 2 | 2s | 2.209614 | -1.61805821 |
| 3 | 3s | 2.344281 | 3.18375966 |
| 4 | 4s | 1.873134 | -2.13919431 |
| 5 | 5s | 7.941732 | -.02906275 |
| 6 | 4s | 10.717069 | -.02435102 |
| 7 | 5s | 16.205034 | .00145047 |
| 8 | 5s | 1.508337 | .01151131 |
| 9 | 4s | 40.825958 | -.00007264 |
| ORB.ENERGY,a.u. | -1.804800 | ||
| NORM | 1.000001 | < R > | 2.925686 | < R2 > | 9.606668 | < 1/R > | .484029 | < 1/R**2 > | 1.800088 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 4.668195 | 1.07924356 |
| 2 | 3p | 5.769118 | -.10158552 |
| 3 | 2p | 11.240309 | .02188596 |
| 4 | 5p | 14.478788 | .00342965 |
| 5 | 4p | 24.418154 | -.00035396 |
| 6 | 5p | 4.832693 | .00555948 |
| 7 | 5p | 69.262967 | -.00000803 |
| 8 | 4p | 2.257095 | .00059109 |
| ORB.ENERGY,a.u. | -9.312700 | ||
| NORM | 1.000000 | < R > | .522870 | < R2 > | .331849 | < 1/R > | 2.426351 | < 1/R**2 > | 8.006643 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 10.410911 | .35362104 |
| 2 | 2s | 4.275836 | -.83627871 |
| 3 | 3s | 6.653904 | -.25518985 |
| 4 | 4s | 18.725229 | .00548504 |
| 5 | 4s | 3.839957 | .05131402 |
| 6 | 2s | 71.529547 | -.00001972 |
| 7 | 3s | 48.446929 | -.00011229 |
| 8 | 2s | 2.316153 | -.03143991 |
| 9 | 5s | 1.761805 | -.01327976 |
| 10 | 4s | 1.489968 | .00964029 |
| ORB.ENERGY,a.u. | -9.202500 | ||
| NORM | 1.000000 | < R > | .591347 | < R2 > | .409922 | < 1/R > | 2.465707 | < 1/R**2 > | 24.620353 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 11.208990 | .92521459 |
| 2 | 1s | 17.492203 | .07626357 |
| 3 | 2s | 9.629475 | .01828463 |
| 4 | 3s | 12.395105 | -.01674491 |
| 5 | 4s | 58.326607 | -.00008410 |
| 6 | 5s | 27.510214 | .00090567 |
| 7 | 5s | 2.124283 | .00131302 |
| 8 | 4s | 2.143908 | -.00103473 |
| ORB.ENERGY,a.u. | -56.187000 |
| NORM | 1.000000 | < R > | .129637 | < R2 > | .022541 | < 1/R > | 11.650856 | < 1/R**2 > | 273.749410 |
Total Energy= -173.54653413 a.u.
Kinetic Energy= 173.53551609 a.u.
Potential Energy= -347.08205023 a.u.
Virial Ratio = -2.00006349