(1s 1 5d 1 ) 3 D B 3+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3252.
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 | .799724 | 3.55313126 |
| 2 | 4d | .800200 | -8.86473277 |
| 3 | 5d | .800416 | 6.00600708 |
| 4 | 3d | 5.143768 | .00059034 |
| 5 | 5d | 3.581950 | .00078638 |
| ORB.ENERGY,a.u. | -.324350 | ||
| NORM | 1.000003 | < R > | 8.618886 | < R2 > | 84.262020 | < 1/R > | .160224 | < 1/R**2 > | .051467 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 4.905317 | .75820594 |
| 2 | 1s | 5.102245 | .25533229 |
| 3 | 2s | 4.950468 | -.01520220 |
| 4 | 3s | 5.283269 | -.00044317 |
| ORB.ENERGY,a.u. | -12.324000 |
| NORM | 1.000000 | < R > | .300015 | < R2 > | .120016 | < 1/R > | 4.999857 | < 1/R**2 > | 49.997891 |
Total Energy= -12.82175824 a.u.
Kinetic Energy= 12.82017953 a.u.
Potential Energy= -25.64193777 a.u.
Virial Ratio = -2.00012314