(1s 2 2s 2 2p 4 3p 1 ) 4 P Cl 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4131.
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 | 3p- electron | |
| 1 | 2p | 5.854409 | .45747573 |
| 2 | 3p | 3.372407 | -.91271139 |
| 3 | 4p | 3.929773 | -.22955607 |
| 4 | 2p | 10.855490 | .07421014 |
| 5 | 5p | 16.826748 | .00480931 |
| 6 | 5p | 44.510050 | -.00023947 |
| 7 | 4p | 68.329285 | -.00003818 |
| 8 | 5p | 3.221801 | -.00767151 |
| ORB.ENERGY,a.u. | -5.559200 | ||
| NORM | 1.000000 | < R > | 1.124843 | < R2 > | 1.452661 | < 1/R > | 1.220955 | < 1/R**2 > | 3.199802 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.658259 | 1.14026281 |
| 2 | 3p | 6.161816 | -.28823881 |
| 3 | 2p | 11.827933 | .12097321 |
| 4 | 4p | 12.310548 | .04875017 |
| 5 | 5p | 14.198732 | -.01761565 |
| 6 | 5p | 3.778428 | .00144744 |
| 7 | 3p | 47.478284 | .00003670 |
| ORB.ENERGY,a.u. | -15.668000 | ||
| NORM | 1.000000 | < R > | .376066 | < R2 > | .173274 | < 1/R > | 3.405987 | < 1/R**2 > | 15.924232 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.515480 | .40318435 |
| 2 | 2s | 7.275928 | -.85309172 |
| 3 | 3s | 6.773404 | -.29916779 |
| 4 | 4s | 17.618497 | .00819813 |
| 5 | 3s | 20.889609 | .00798147 |
| 6 | 5s | 34.632885 | .00055893 |
| 7 | 5s | 6.248078 | -.00780209 |
| 8 | 2s | 66.758901 | .00002563 |
| ORB.ENERGY,a.u. | -16.930000 | ||
| NORM | 1.000000 | < R > | .422038 | < R2 > | .209642 | < 1/R > | 3.471669 | < 1/R**2 > | 49.237612 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.157702 | .92124866 |
| 2 | 1s | 23.443030 | .07498870 |
| 3 | 2s | 10.684751 | .01986630 |
| 4 | 3s | 12.914612 | -.01975253 |
| 5 | 4s | 15.484245 | .00913022 |
| 6 | 5s | 41.265188 | .00072261 |
| 7 | 4s | 95.080164 | -.00003011 |
| ORB.ENERGY,a.u. | -112.130000 |
| NORM | 1.000000 | < R > | .091052 | < R2 > | .011126 | < 1/R > | 16.587488 | < 1/R**2 > | 554.416121 |
Total Energy= -422.79458023 a.u.
Kinetic Energy= 422.89140804 a.u.
Potential Energy= -845.68598828 a.u.
Virial Ratio = -1.99977103