(1s 2 2s 2 2p 2 5p 1 ) 2 P Ne 3+
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 | 2.120021 | .20837909 |
| 2 | 3p | 1.180814 | -1.70873691 |
| 3 | 4p | .877661 | 5.47772462 |
| 4 | 5p | .859745 | -4.68870126 |
| 5 | 2p | 5.584104 | .03538647 |
| 6 | 5p | 5.922714 | .00086863 |
| 7 | 3p | 10.818632 | -.00104494 |
| 8 | 3p | .355913 | -.00084131 |
| ORB.ENERGY,a.u. | -.361490 | ||
| NORM | 1.000006 | < R > | 8.077073 | < R2 > | 73.277839 | < 1/R > | .169943 | < 1/R**2 > | .086416 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.313866 | .84634746 |
| 2 | 2p | 5.551666 | .17137847 |
| 3 | 2p | 12.268432 | .00610512 |
| 4 | 3p | .738554 | -.17739020 |
| 5 | 4p | .981294 | .17414869 |
| 6 | 4p | 2.665778 | .01164671 |
| 7 | 5p | 42.674994 | .00004603 |
| 8 | 3p | 45.746733 | .00001666 |
| ORB.ENERGY,a.u. | -4.433400 | ||
| NORM | 1.000000 | < R > | .699510 | < R2 > | .615567 | < 1/R > | 1.837851 | < 1/R**2 > | 4.655555 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.179280 | .35244662 |
| 2 | 2s | 3.948003 | -.84046396 |
| 3 | 3s | 3.714138 | -.27695634 |
| 4 | 4s | 15.857557 | .00275661 |
| 5 | 3s | 9.724213 | .02202439 |
| 6 | 5s | 3.793280 | -.02151924 |
| 7 | 5s | 64.462175 | -.00000936 |
| 8 | 3s | 3.051831 | .00472922 |
| ORB.ENERGY,a.u. | -3.873300 | ||
| NORM | 1.000000 | < R > | .767223 | < R2 > | .693996 | < 1/R > | 1.885630 | < 1/R**2 > | 14.476593 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 8.709209 | .61335146 |
| 2 | 1s | 13.271725 | .30145444 |
| 3 | 1s | 5.893505 | .00704670 |
| 4 | 2s | 10.365141 | .13442580 |
| 5 | 3s | 10.773299 | -.04339626 |
| 6 | 4s | 18.419296 | .00288160 |
| 7 | 5s | 60.984476 | -.00004011 |
| 8 | 4s | 5.171191 | .00033231 |
| ORB.ENERGY,a.u. | -35.222000 |
| NORM | 1.000000 | < R > | .157000 | < R2 > | .033129 | < 1/R > | 9.640998 | < 1/R**2 > | 187.870984 |
Total Energy= -120.91185013 a.u.
Kinetic Energy= 120.90501879 a.u.
Potential Energy= -241.81686892 a.u.
Virial Ratio = -2.00005650