(1s 2 2s 2 2p 1 4d 1 ) 1 F Na 5+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1342.
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 | 1.666128 | 1.49399148 |
| 2 | 4d | 1.487238 | -1.98339290 |
| 3 | 3d | 5.073452 | .01263023 |
| 4 | 5d | 27.010453 | .00007011 |
| 5 | 4d | 9.327890 | .00150371 |
| 6 | 5d | 1.073278 | .00216168 |
| 7 | 3d | 25.008621 | .00002926 |
| ORB.ENERGY,a.u. | -1.130800 | ||
| NORM | 1.000001 | < R > | 3.466305 | < R2 > | 13.772194 | < 1/R > | .382756 | < 1/R**2 > | .239733 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 4.158144 | 1.07651716 |
| 2 | 3p | 4.993015 | -.10731937 |
| 3 | 2p | 9.856388 | .02842134 |
| 4 | 5p | 12.274514 | .00540290 |
| 5 | 4p | 23.952267 | -.00039868 |
| 6 | 5p | 4.566591 | .00640493 |
| 7 | 5p | 76.460387 | -.00000687 |
| 8 | 3p | 1.508044 | .00208674 |
| ORB.ENERGY,a.u. | -7.221400 | ||
| NORM | 1.000000 | < R > | .582678 | < R2 > | .412680 | < 1/R > | 2.180457 | < 1/R**2 > | 6.477378 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.721185 | .33550186 |
| 2 | 2s | 3.807086 | -.79502422 |
| 3 | 3s | 5.839157 | -.27433780 |
| 4 | 4s | 20.837802 | .00164663 |
| 5 | 5s | 11.444150 | -.01554236 |
| 6 | 5s | 4.289751 | .02167233 |
| ORB.ENERGY,a.u. | -7.150900 | ||
| NORM | 1.000000 | < R > | .657960 | < R2 > | .507767 | < 1/R > | 2.209639 | < 1/R**2 > | 19.783749 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.213773 | .92144075 |
| 2 | 1s | 15.998830 | .08124389 |
| 3 | 2s | 8.828617 | .01659738 |
| 4 | 3s | 11.373263 | -.01613917 |
| 5 | 4s | 53.503641 | -.00008430 |
| 6 | 5s | 25.505183 | .00100107 |
| 7 | 4s | 5.148790 | .00007817 |
| ORB.ENERGY,a.u. | -46.135000 |
| NORM | 1.000000 | < R > | .141854 | < R2 > | .027000 | < 1/R > | 10.653381 | < 1/R**2 > | 229.041994 |
Total Energy= -143.60857954 a.u.
Kinetic Energy= 143.57707352 a.u.
Potential Energy= -287.18565306 a.u.
Virial Ratio = -2.00021944