(1s 1 5p 1 ) 3 P P 13+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3151.
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 | 5p- electron | |
| 1 | 2p | 2.150512 | 5.84406483 |
| 2 | 3p | 3.507094 | -6.71929962 |
| 3 | 4p | 2.488832 | 9.37863439 |
| 4 | 5p | 2.682524 | -9.99992382 |
| 5 | 5p | 7.187230 | .04648429 |
| 6 | 4p | 16.686954 | -.00488453 |
| 7 | 5p | 37.715699 | -.00044844 |
| 8 | 4p | 1.166398 | -.01031725 |
| 9 | 4p | 57.131344 | -.00009066 |
| 10 | 5p | 1.111103 | .00411728 |
| ORB.ENERGY,a.u. | -4.279800 | ||
| NORM | 1.000000 | < R > | 2.594681 | < R2 > | 7.580285 | < 1/R > | .563359 | < 1/R**2 > | 1.069944 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.758728 | .88941610 |
| 2 | 1s | 17.401825 | .10550346 |
| 3 | 2s | 16.173490 | .01023423 |
| 4 | 3s | 15.253719 | -.00529241 |
| 5 | 4s | 17.388955 | .00024551 |
| 6 | 5s | 18.914408 | .00033329 |
| ORB.ENERGY,a.u. | -112.280000 |
| NORM | 1.000000 | < R > | .100017 | < R2 > | .013338 | < 1/R > | 14.998072 | < 1/R**2 > | 449.904576 |
Total Energy= -116.43227649 a.u.
Kinetic Energy= 116.43846461 a.u.
Potential Energy= -232.87074110 a.u.
Virial Ratio = -1.99994685