(1s 2 2s 2 5p 1 ) 2 P P 10+
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 | 1.786002 | 3.89525157 |
| 2 | 3p | 2.813891 | -5.40984426 |
| 3 | 4p | 2.259972 | 6.47233634 |
| 4 | 5p | 2.228377 | -6.06614002 |
| 5 | 2p | 9.230734 | .04895177 |
| 6 | 5p | 10.605168 | .01242495 |
| 7 | 4p | 13.511723 | .00762564 |
| 8 | 5p | 34.292459 | -.00009591 |
| ORB.ENERGY,a.u. | -2.524100 | ||
| NORM | 1.000003 | < R > | 3.183199 | < R2 > | 11.404991 | < 1/R > | .458916 | < 1/R**2 > | .738727 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 12.635963 | .39619740 |
| 2 | 2s | 6.065704 | -.80284999 |
| 3 | 3s | 7.941266 | -.29259250 |
| 4 | 5s | 14.757940 | -.01561646 |
| 5 | 4s | 29.435737 | .00253893 |
| 6 | 5s | 6.246139 | .00472089 |
| 7 | 5s | 43.060324 | -.00039582 |
| ORB.ENERGY,a.u. | -3.224300 | ||
| NORM | 1.000000 | < R > | .446427 | < R2 > | .232775 | < 1/R > | 3.290160 | < 1/R**2 > | 43.612474 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 14.192148 | .93868170 |
| 2 | 1s | 22.888052 | .05983285 |
| 3 | 2s | 15.641857 | .01959572 |
| 4 | 3s | 17.354427 | -.01641155 |
| 5 | 5s | 33.688645 | .00103609 |
| 6 | 4s | 76.615398 | -.00006132 |
| 7 | 5s | 16.175026 | -.00027462 |
| ORB.ENERGY,a.u. | -97.525000 |
| NORM | 1.000000 | < R > | .102735 | < R2 > | .014126 | < 1/R > | 14.669854 | < 1/R**2 > | 433.003069 |
Total Energy= -261.02257654 a.u.
Kinetic Energy= 261.02255205 a.u.
Potential Energy= -522.04512858 a.u.
Virial Ratio = -2.00000009