(1s 2 2s 2 2p 1 5d 1 ) 1 P Na 5+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1152.
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 | 1.192890 | 3.53991557 |
| 2 | 4d | 1.202819 | -8.87726540 |
| 3 | 5d | 1.206471 | 6.01019785 |
| 4 | 3d | 5.224822 | .01597897 |
| 5 | 5d | 4.047763 | .01068651 |
| 6 | 5d | .847728 | .00325447 |
| 7 | 4d | 12.921697 | -.00018255 |
| ORB.ENERGY,a.u. | -.724530 | ||
| NORM | 1.000006 | < R > | 5.697937 | < R2 > | 36.893985 | < 1/R > | .245286 | < 1/R**2 > | .124857 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 4.113708 | 1.10072954 |
| 2 | 3p | 4.892076 | -.13070210 |
| 3 | 2p | 9.772267 | .02938004 |
| 4 | 5p | 12.153127 | .00562063 |
| 5 | 4p | 23.805050 | -.00043992 |
| 6 | 5p | 75.504805 | -.00000803 |
| 7 | 5p | 4.078197 | .00274811 |
| 8 | 3p | 2.337761 | .00032054 |
| ORB.ENERGY,a.u. | -7.384900 | ||
| NORM | 1.000000 | < R > | .583396 | < R2 > | .413689 | < 1/R > | 2.178114 | < 1/R**2 > | 6.464968 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.718325 | .33592492 |
| 2 | 2s | 3.810487 | -.79576621 |
| 3 | 3s | 5.826849 | -.27460157 |
| 4 | 4s | 20.830149 | .00160829 |
| 5 | 5s | 11.489045 | -.01570073 |
| 6 | 5s | 4.325657 | .02310321 |
| ORB.ENERGY,a.u. | -7.150900 | ||
| NORM | 1.000000 | < R > | .657394 | < R2 > | .506798 | < 1/R > | 2.211466 | < 1/R**2 > | 19.813873 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.213770 | .92141518 |
| 2 | 1s | 15.999020 | .08125739 |
| 3 | 2s | 8.837958 | .01660339 |
| 4 | 3s | 11.378369 | -.01613950 |
| 5 | 4s | 53.571681 | -.00008383 |
| 6 | 5s | 25.508064 | .00100507 |
| 7 | 4s | 5.188851 | .00007895 |
| ORB.ENERGY,a.u. | -46.135000 |
| NORM | 1.000000 | < R > | .141853 | < R2 > | .026999 | < 1/R > | 10.653423 | < 1/R**2 > | 229.043313 |
Total Energy= -143.18660992 a.u.
Kinetic Energy= 143.17081761 a.u.
Potential Energy= -286.35742753 a.u.
Virial Ratio = -2.00011030