(1s 2 2s 2 2p 2 5p 1 ) 2 P N 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
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 | 1.437131 | .02623739 |
| 2 | 3p | .195556 | -5.66725308 |
| 3 | 4p | .281356 | 5.53876417 |
| 4 | 5p | 1.229198 | -.04100231 |
| 5 | 2p | 3.387409 | .01114556 |
| 6 | 5p | 3.607397 | .00152541 |
| 7 | 5p | .793258 | -.12667549 |
| 8 | 3p | 6.373714 | -.00069965 |
| 9 | 2p | .096660 | .04072500 |
| ORB.ENERGY,a.u. | -.026177 | ||
| NORM | .999993 | < R > | 27.767815 | < R2 > | 867.416622 | < 1/R > | .048251 | < 1/R**2 > | .005374 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 1.761120 | .65109124 |
| 2 | 2p | 2.719038 | .36579528 |
| 3 | 2p | 6.785259 | .02125758 |
| 4 | 5p | 8.530358 | .00284363 |
| 5 | 5p | .334733 | .02662573 |
| 6 | 4p | .207442 | -.02835567 |
| 7 | 4p | 3.713399 | -.03870204 |
| 8 | 3p | 1.488930 | .05056565 |
| 9 | 2p | .530259 | -.00678067 |
| 10 | 3p | 27.093252 | .00000819 |
| ORB.ENERGY,a.u. | -.999670 | ||
| NORM | 1.000000 | < R > | 1.245040 | < R2 > | 2.037623 | < 1/R > | 1.056740 | < 1/R**2 > | 1.582266 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 5.901329 | .28593597 |
| 2 | 2s | 2.451181 | -.83274307 |
| 3 | 3s | 1.982929 | -.26774300 |
| 4 | 4s | 8.386017 | .02211598 |
| 5 | 3s | 10.281890 | .00677205 |
| 6 | 5s | 2.798117 | -.01292027 |
| 7 | 5s | 16.565680 | .00089244 |
| 8 | 3s | .921081 | -.00040516 |
| ORB.ENERGY,a.u. | -.654320 | ||
| NORM | 1.000000 | < R > | 1.253051 | < R2 > | 1.874914 | < 1/R > | 1.140638 | < 1/R**2 > | 5.285091 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.229982 | .71792548 |
| 2 | 1s | 9.301984 | .22516768 |
| 3 | 1s | 2.654016 | .00485047 |
| 4 | 2s | 6.904022 | .08341656 |
| 5 | 3s | 7.777197 | -.02158238 |
| 6 | 4s | 12.680941 | .00688850 |
| 7 | 5s | 28.043871 | .00017117 |
| ORB.ENERGY,a.u. | -15.024000 |
| NORM | 1.000000 | < R > | .228087 | < R2 > | .070096 | < 1/R > | 6.656688 | < 1/R**2 > | 89.910179 |
Total Energy= -53.91475195 a.u.
Kinetic Energy= 53.91418613 a.u.
Potential Energy= -107.82893808 a.u.
Virial Ratio = -2.00001049