(1s 2 2s 2 2p 2 5p 1 ) 4 P Cl 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4151.
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 | 4.792483 | .37485184 |
| 2 | 3p | 2.641265 | -3.38530028 |
| 3 | 4p | 2.365034 | 7.95099205 |
| 4 | 5p | 2.297039 | -5.53126221 |
| 5 | 2p | 9.957347 | .05148484 |
| 6 | 5p | 35.253966 | -.00051472 |
| 7 | 4p | 54.235429 | -.00009195 |
| 8 | 4p | 1.700480 | -.02669863 |
| ORB.ENERGY,a.u. | -2.598700 | ||
| NORM | 1.000003 | < R > | 3.093220 | < R2 > | 10.759620 | < 1/R > | .467424 | < 1/R**2 > | .768936 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.777301 | 1.12748267 |
| 2 | 3p | 7.899745 | -.15118999 |
| 3 | 2p | 15.748523 | .02272674 |
| 4 | 4p | 17.226659 | .00522157 |
| 5 | 5p | 37.909240 | -.00023071 |
| 6 | 5p | 1.484265 | .00009542 |
| 7 | 4p | 6.349258 | -.00295045 |
| ORB.ENERGY,a.u. | -65.110000 | ||
| NORM | 1.000000 | < R > | .351417 | < R2 > | .149742 | < 1/R > | 3.604078 | < 1/R**2 > | 17.615240 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.330994 | .43077933 |
| 2 | 2s | 7.487816 | -.86865430 |
| 3 | 3s | 7.646041 | -.28600935 |
| 4 | 4s | 28.771998 | .00196446 |
| 5 | 3s | 15.625789 | .01743286 |
| 6 | 5s | 7.712013 | -.02090877 |
| ORB.ENERGY,a.u. | -20.297000 | ||
| NORM | 1.000000 | < R > | .404066 | < R2 > | .191254 | < 1/R > | 3.634052 | < 1/R**2 > | 53.558717 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.060166 | .92145721 |
| 2 | 1s | 24.152135 | .07729853 |
| 3 | 2s | 15.009571 | .01929481 |
| 4 | 3s | 18.606957 | -.01560912 |
| 5 | 5s | 40.395309 | .00085051 |
| 6 | 4s | 97.359099 | -.00003096 |
| 7 | 5s | 12.763388 | .00031092 |
| ORB.ENERGY,a.u. | -117.740000 |
| NORM | 1.000000 | < R > | .090734 | < R2 > | .011032 | < 1/R > | 16.624653 | < 1/R**2 > | 556.346314 |
Total Energy= -383.75294167 a.u.
Kinetic Energy= 383.75949748 a.u.
Potential Energy= -767.51243915 a.u.
Virial Ratio = -1.99998292