(1s 2 2s 2 2p 1 5d 1 ) 1 F N +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1352.
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 | .451406 | 2.31622441 |
| 2 | 4d | .408903 | -6.23902966 |
| 3 | 5d | .394449 | 4.85374222 |
| 4 | 3d | 4.198175 | .00611836 |
| 5 | 4d | .323894 | -.20363610 |
| 6 | 5d | 1.737614 | -.00550660 |
| 7 | 4d | 5.595409 | -.00324117 |
| 8 | 3d | 6.938342 | -.00089357 |
| ORB.ENERGY,a.u. | -.079608 | ||
| NORM | 1.000004 | < R > | 17.330633 | < R2 > | 340.767304 | < 1/R > | .079803 | < 1/R**2 > | .012837 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 2.078258 | .82981294 |
| 2 | 2p | 3.481601 | .18268875 |
| 3 | 2p | 7.966499 | .00896656 |
| 4 | 3p | 4.034830 | -.00641230 |
| 5 | 4p | 2.008155 | .01995254 |
| 6 | 4p | 11.851605 | -.00065734 |
| 7 | 5p | .648206 | .00025639 |
| ORB.ENERGY,a.u. | -1.628400 | ||
| NORM | 1.000000 | < R > | 1.119331 | < R2 > | 1.540183 | < 1/R > | 1.151997 | < 1/R**2 > | 1.843975 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 6.426831 | .26769635 |
| 2 | 2s | 2.001856 | -.76142349 |
| 3 | 3s | 3.460761 | -.27627286 |
| 4 | 4s | 13.138482 | .00229678 |
| 5 | 5s | 7.043618 | -.02346158 |
| 6 | 5s | 2.255233 | .03143423 |
| 7 | 4s | 28.576216 | .00003535 |
| 8 | 4s | 1.850850 | -.00903843 |
| ORB.ENERGY,a.u. | -1.962200 | ||
| NORM | 1.000000 | < R > | 1.179302 | < R2 > | 1.644125 | < 1/R > | 1.210989 | < 1/R**2 > | 5.925925 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.269773 | .00613039 |
| 2 | 1s | 6.254564 | .70946613 |
| 3 | 1s | 9.331968 | .22643628 |
| 4 | 2s | 7.139492 | .08427849 |
| 5 | 3s | 7.703879 | -.01452674 |
| 6 | 4s | 12.792386 | .00522655 |
| 7 | 5s | 22.118906 | .00018783 |
| ORB.ENERGY,a.u. | -16.800000 |
| NORM | 1.000000 | < R > | .227667 | < R2 > | .069769 | < 1/R > | 6.663934 | < 1/R**2 > | 90.056812 |
Total Energy= -52.89766300 a.u.
Kinetic Energy= 52.89539959 a.u.
Potential Energy= -105.79306259 a.u.
Virial Ratio = -2.00004279