(1s 2 2s 2 2p 2 4p 1 ) 2 P Cl 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2141.
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 | 7.848203 | .25327393 |
| 2 | 3p | 2.750117 | -.60972484 |
| 3 | 5p | 3.103137 | 1.54009080 |
| 4 | 4p | 4.489535 | -.63773298 |
| 5 | 5p | 9.739252 | .04118017 |
| 6 | 4p | 22.620758 | -.00213666 |
| 7 | 5p | 2.638244 | .10522050 |
| 8 | 5p | 50.891605 | -.00026292 |
| 9 | 4p | 80.014966 | -.00004698 |
| ORB.ENERGY,a.u. | -4.071500 | ||
| NORM | .999999 | < R > | 1.945441 | < R2 > | 4.276113 | < 1/R > | .710121 | < 1/R**2 > | 1.318492 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.104060 | 1.17269769 |
| 2 | 3p | 9.661587 | -.20542447 |
| 3 | 4p | 12.622411 | .03225834 |
| 4 | 5p | 3.030148 | .09033831 |
| 5 | 4p | 2.629199 | -.10614874 |
| 6 | 3p | 2.107345 | .03126961 |
| 7 | 5p | 40.022556 | -.00023960 |
| 8 | 3p | 24.768118 | -.00058071 |
| ORB.ENERGY,a.u. | -65.059000 | ||
| NORM | 1.000000 | < R > | .350248 | < R2 > | .149515 | < 1/R > | 3.615729 | < 1/R**2 > | 17.710048 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.307803 | .43158052 |
| 2 | 2s | 7.502790 | -.86897102 |
| 3 | 3s | 7.662397 | -.28598897 |
| 4 | 4s | 28.997045 | .00197309 |
| 5 | 3s | 15.323503 | .01916398 |
| 6 | 5s | 7.739518 | -.02417542 |
| 7 | 4s | 2.439607 | .00014760 |
| ORB.ENERGY,a.u. | -20.297000 | ||
| NORM | 1.000000 | < R > | .404365 | < R2 > | .191557 | < 1/R > | 3.631302 | < 1/R**2 > | 53.484573 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.059577 | .92146381 |
| 2 | 1s | 24.151551 | .07730001 |
| 3 | 2s | 14.980405 | .01930875 |
| 4 | 3s | 18.607404 | -.01560991 |
| 5 | 5s | 40.356595 | .00085058 |
| 6 | 4s | 97.368594 | -.00003091 |
| 7 | 5s | 12.951423 | .00030050 |
| ORB.ENERGY,a.u. | -117.740000 |
| NORM | 1.000000 | < R > | .090741 | < R2 > | .011034 | < 1/R > | 16.623852 | < 1/R**2 > | 556.303987 |
Total Energy= -385.28520458 a.u.
Kinetic Energy= 385.23059945 a.u.
Potential Energy= -770.51580404 a.u.
Virial Ratio = -2.00014175