(1s 2 2s 2 2p 1 5d 1 ) 3 F P 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3352.
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 | 2.632752 | 1.36434815 |
| 2 | 4d | 2.162776 | -4.12987143 |
| 3 | 5d | 1.999845 | 3.45713950 |
| 4 | 3d | 5.764655 | .05212479 |
| 5 | 5d | 8.354832 | -.00829742 |
| 6 | 5d | 1.608546 | -.02442790 |
| 7 | 4d | 36.717756 | .00003494 |
| 8 | 3d | 75.092222 | .00000103 |
| ORB.ENERGY,a.u. | -2.055500 | ||
| NORM | 1.000000 | < R > | 3.349712 | < R2 > | 12.733586 | < 1/R > | .415520 | < 1/R**2 > | .358947 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.126441 | 1.10255836 |
| 2 | 3p | 7.426207 | -.11542233 |
| 3 | 2p | 15.309128 | .01314612 |
| 4 | 5p | 19.113642 | .00226686 |
| 5 | 4p | 26.203365 | -.00018003 |
| 6 | 5p | 2.369577 | .00128582 |
| 7 | 5p | 51.020734 | -.00001586 |
| 8 | 4p | 2.340497 | -.00149225 |
| ORB.ENERGY,a.u. | -17.209000 | ||
| NORM | 1.000000 | < R > | .396968 | < R2 > | .190716 | < 1/R > | 3.184208 | < 1/R**2 > | 13.723077 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.941740 | .37318591 |
| 2 | 2s | 5.669304 | -.80903533 |
| 3 | 3s | 8.181070 | -.28220594 |
| 4 | 4s | 28.237847 | .00124555 |
| 5 | 5s | 16.061280 | -.01114204 |
| 6 | 5s | 6.315675 | .01755842 |
| ORB.ENERGY,a.u. | -16.877000 | ||
| NORM | 1.000000 | < R > | .456525 | < R2 > | .243867 | < 1/R > | 3.212050 | < 1/R**2 > | 41.729431 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.165796 | .93089317 |
| 2 | 1s | 21.884536 | .06869393 |
| 3 | 2s | 13.047495 | .01920855 |
| 4 | 3s | 16.065511 | -.01652844 |
| 5 | 4s | 74.202971 | -.00006348 |
| 6 | 5s | 34.556257 | .00079626 |
| 7 | 5s | 9.025802 | .00006944 |
| ORB.ENERGY,a.u. | -92.406000 |
| NORM | 1.000000 | < R > | .102967 | < R2 > | .014203 | < 1/R > | 14.648393 | < 1/R**2 > | 432.016577 |
Total Energy= -278.14027042 a.u.
Kinetic Energy= 278.15082082 a.u.
Potential Energy= -556.29109124 a.u.
Virial Ratio = -1.99996207