(1s 2 2s 2 2p 1 4p 1 ) 1 P Ne 4+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1141.
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 | 4p- electron | |
| 1 | 2p | 2.981644 | .37638335 |
| 2 | 3p | 1.395006 | -2.59768001 |
| 3 | 4p | 1.382635 | 2.93912297 |
| 4 | 5p | 5.892863 | -.01885655 |
| 5 | 2p | 6.797576 | .03043420 |
| 6 | 5p | 1.162578 | .01499208 |
| 7 | 3p | 11.402886 | -.00153279 |
| ORB.ENERGY,a.u. | -.906880 | ||
| NORM | 1.000001 | < R > | 3.971017 | < R2 > | 17.818090 | < 1/R > | .353241 | < 1/R**2 > | .353289 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.594428 | .87656168 |
| 2 | 2p | 5.441128 | .14898526 |
| 3 | 2p | 12.100153 | .00614307 |
| 4 | 3p | 5.734170 | -.02224059 |
| 5 | 4p | 3.347218 | .01067040 |
| 6 | 4p | 16.838799 | -.00071292 |
| ORB.ENERGY,a.u. | -5.482300 | ||
| NORM | 1.000000 | < R > | .662063 | < R2 > | .533759 | < 1/R > | 1.923753 | < 1/R**2 > | 5.058349 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.872873 | .32426508 |
| 2 | 2s | 3.382074 | -.79254268 |
| 3 | 3s | 5.252388 | -.27237194 |
| 4 | 4s | 16.738004 | .00337392 |
| 5 | 5s | 10.452027 | -.01163933 |
| 6 | 5s | 3.701143 | .01576102 |
| 7 | 4s | 30.127942 | .00016698 |
| 8 | 3s | .948735 | .00021652 |
| ORB.ENERGY,a.u. | -6.198000 | ||
| NORM | 1.000000 | < R > | .739808 | < R2 > | .642608 | < 1/R > | 1.958704 | < 1/R**2 > | 15.549391 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 1.470432 | .00001807 |
| 2 | 1s | 9.269706 | .89188786 |
| 3 | 1s | 13.711126 | .10448685 |
| 4 | 2s | 7.383631 | .01513024 |
| 5 | 3s | 10.882963 | -.00732362 |
| 6 | 4s | 18.657162 | .00415959 |
| 7 | 5s | 10.301217 | -.00193137 |
| 8 | 5s | 36.685830 | .00008370 |
| ORB.ENERGY,a.u. | -38.512000 |
| NORM | 1.000000 | < R > | .156653 | < R2 > | .032948 | < 1/R > | 9.654259 | < 1/R**2 > | 188.266905 |
Total Energy= -116.80011772 a.u.
Kinetic Energy= 116.81753459 a.u.
Potential Energy= -233.61765231 a.u.
Virial Ratio = -1.99985091