(1s 2 2s 2 2p 1 5p 1 ) 3 P F 3+
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 | 3.643832 | .09438092 |
| 2 | 3p | 1.121183 | -2.15540960 |
| 3 | 4p | .969983 | 4.39118191 |
| 4 | 5p | .846723 | -3.09522581 |
| 5 | 2p | 1.472070 | .14476666 |
| 6 | 5p | 4.031626 | .03723317 |
| 7 | 3p | 7.416849 | -.00510759 |
| ORB.ENERGY,a.u. | -.362770 | ||
| NORM | 1.000003 | < R > | 8.036460 | < R2 > | 72.590817 | < 1/R > | .167382 | < 1/R**2 > | .069260 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.414145 | .93393080 |
| 2 | 3p | .560261 | -.33137531 |
| 3 | 2p | 8.030006 | .02740576 |
| 4 | 5p | 4.003191 | .07789215 |
| 5 | 4p | 14.968040 | -.00175015 |
| 6 | 5p | 1.170176 | .20666307 |
| 7 | 4p | .581051 | .13079044 |
| 8 | 2p | 26.092984 | .00006096 |
| ORB.ENERGY,a.u. | -4.016100 | ||
| NORM | 1.000000 | < R > | .777461 | < R2 > | .902028 | < 1/R > | 1.678533 | < 1/R**2 > | 3.862968 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.079952 | .30804159 |
| 2 | 2s | 2.895953 | -.78825490 |
| 3 | 3s | 4.667438 | -.27090236 |
| 4 | 4s | 16.389468 | .00244116 |
| 5 | 5s | 9.223444 | -.01698545 |
| 6 | 5s | 3.308930 | .02581884 |
| 7 | 4s | 34.178704 | .00004469 |
| ORB.ENERGY,a.u. | -4.533500 | ||
| NORM | 1.000000 | < R > | .843729 | < R2 > | .836882 | < 1/R > | 1.710733 | < 1/R**2 > | 11.858253 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.432434 | .00128642 |
| 2 | 1s | 8.052961 | .85104222 |
| 3 | 1s | 12.614002 | .14431305 |
| 4 | 2s | 11.026033 | .02093143 |
| 5 | 3s | 9.824448 | -.01580844 |
| 6 | 4s | 15.763485 | .00482259 |
| 7 | 5s | 28.890239 | .00027498 |
| ORB.ENERGY,a.u. | -30.269000 |
| NORM | 1.000000 | < R > | .174839 | < R2 > | .041070 | < 1/R > | 8.657192 | < 1/R**2 > | 151.542849 |
Total Energy= -92.48918500 a.u.
Kinetic Energy= 92.48949580 a.u.
Potential Energy= -184.97868080 a.u.
Virial Ratio = -1.99999664