(1s 1 5d 1 ) 1 D F 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1252.
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 | 1.600643 | 3.54405682 |
2 | 4d | 1.600201 | -8.85359780 |
3 | 5d | 1.599930 | 5.99961333 |
4 | 3d | 4.292341 | .00112315 |
5 | 5d | 2.551937 | .00570492 |
6 | 4d | 6.425842 | -.00101599 |
7 | 5d | 15.972723 | -.00013548 |
ORB.ENERGY,a.u. | -1.323600 |
NORM | 1.000002 | < R > | 4.313495 | < R2 > | 21.102790 | < 1/R > | .319867 | < 1/R**2 > | .204515 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 8.855568 | .75724005 |
2 | 1s | 9.102480 | .25653005 |
3 | 2s | 8.917968 | -.01575904 |
4 | 3s | 8.550289 | -.00016441 |
ORB.ENERGY,a.u. | -40.204000 |
NORM | 1.000000 | < R > | .166664 | < R2 > | .037035 | < 1/R > | 9.000091 | < 1/R**2 > | 162.002488 |
Total Energy= -41.78415555 a.u.
Kinetic Energy= 41.77975056 a.u.
Potential Energy= -83.56390612 a.u.
Virial Ratio = -2.00010543