(1s 2 2s 2 2p 3 5p 1 ) 5 P Ne 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 5151.
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 | 2.578555 | .11010053 |
| 2 | 3p | 1.088709 | -.99214220 |
| 3 | 4p | .759091 | 2.93793444 |
| 4 | 5p | .670954 | -2.69952876 |
| 5 | 2p | 5.274284 | .04219034 |
| 6 | 5p | 7.098237 | .00254348 |
| 7 | 3p | 10.322846 | -.00147359 |
| ORB.ENERGY,a.u. | -.221010 | ||
| NORM | 1.000001 | < R > | 9.895469 | < R2 > | 110.083334 | < 1/R > | .142880 | < 1/R**2 > | .076091 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.013172 | .75981244 |
| 2 | 2p | 4.904790 | .24478776 |
| 3 | 2p | 9.849643 | .01745912 |
| 4 | 3p | 4.140341 | .00037696 |
| 5 | 4p | 2.780332 | .01517194 |
| 6 | 5p | 12.501154 | .00295356 |
| 7 | 5p | 1.513670 | -.00015627 |
| ORB.ENERGY,a.u. | -3.405000 | ||
| NORM | 1.000000 | < R > | .743105 | < R2 > | .682705 | < 1/R > | 1.744470 | < 1/R**2 > | 4.243280 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.245606 | .33444606 |
| 2 | 2s | 3.859296 | -.82439840 |
| 3 | 3s | 3.278327 | -.28640443 |
| 4 | 4s | 12.317991 | .01433215 |
| 5 | 3s | 14.623099 | .00488281 |
| 6 | 5s | 24.177035 | .00063096 |
| 7 | 5s | 5.339957 | -.00984491 |
| 8 | 4s | 6.764522 | -.00554037 |
| ORB.ENERGY,a.u. | -3.109400 | ||
| NORM | 1.000000 | < R > | .797607 | < R2 > | .754116 | < 1/R > | 1.812496 | < 1/R**2 > | 13.437941 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 9.071221 | .86632168 |
| 2 | 1s | 13.142841 | .14165702 |
| 3 | 1s | 2.100570 | -.00210620 |
| 4 | 2s | 7.957358 | -.00743751 |
| 5 | 3s | 6.352702 | .00605570 |
| 6 | 4s | 19.402919 | .00301944 |
| 7 | 5s | 57.464898 | -.00002124 |
| 8 | 5s | 3.993951 | .00081335 |
| ORB.ENERGY,a.u. | -33.976000 |
| NORM | 1.000000 | < R > | .157278 | < R2 > | .033276 | < 1/R > | 9.630566 | < 1/R**2 > | 187.561400 |
Total Energy= -124.32238522 a.u.
Kinetic Energy= 124.32520072 a.u.
Potential Energy= -248.64758594 a.u.
Virial Ratio = -1.99997735