(1s 2 2s 2 2p 2 4d 1 ) 4 F P 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4342.
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 | 4d- electron | |
| 1 | 3d | 2.789343 | 1.09614418 |
| 2 | 4d | 2.250687 | -1.64621125 |
| 3 | 3d | 5.849932 | .07138752 |
| 4 | 4d | 7.117651 | -.01639312 |
| 5 | 5d | 2.037955 | .02807804 |
| 6 | 5d | 22.278559 | -.00040425 |
| 7 | 4d | 36.955582 | -.00003395 |
| ORB.ENERGY,a.u. | -2.643700 | ||
| NORM | 1.000000 | < R > | 2.217445 | < R2 > | 5.635365 | < 1/R > | .601175 | < 1/R**2 > | .603500 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.844852 | 1.15387011 |
| 2 | 3p | 7.051332 | -.17347805 |
| 3 | 2p | 14.297148 | .01865779 |
| 4 | 4p | 15.290917 | .00344938 |
| 5 | 5p | 28.113840 | -.00029999 |
| 6 | 5p | 2.595367 | -.00043751 |
| 7 | 4p | 30.991920 | -.00029501 |
| ORB.ENERGY,a.u. | -15.019000 | ||
| NORM | 1.000000 | < R > | .410167 | < R2 > | .204396 | < 1/R > | 3.095621 | < 1/R**2 > | 13.037068 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 11.922888 | .41151774 |
| 2 | 2s | 6.452213 | -.85421619 |
| 3 | 3s | 6.608784 | -.28059386 |
| 4 | 4s | 24.884247 | .00220610 |
| 5 | 3s | 14.235025 | .01652412 |
| 6 | 5s | 6.656385 | -.02721280 |
| ORB.ENERGY,a.u. | -14.334000 | ||
| NORM | 1.000000 | < R > | .467473 | < R2 > | .256268 | < 1/R > | 3.132044 | < 1/R**2 > | 39.833638 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.110173 | .92171017 |
| 2 | 1s | 21.590202 | .07718890 |
| 3 | 2s | 13.474070 | .01931922 |
| 4 | 3s | 16.734609 | -.01553519 |
| 5 | 5s | 35.672646 | .00099014 |
| 6 | 4s | 86.676894 | -.00003316 |
| 7 | 5s | 11.517040 | .00053064 |
| ORB.ENERGY,a.u. | -89.095000 |
| NORM | 1.000000 | < R > | .103184 | < R2 > | .014275 | < 1/R > | 14.628657 | < 1/R**2 > | 431.112107 |
Total Energy= -294.31154557 a.u.
Kinetic Energy= 294.33874524 a.u.
Potential Energy= -588.65029081 a.u.
Virial Ratio = -1.99990759