(1s 2 2s 1 5p 1 ) 1 P Cl 13+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1151.
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 | 2.110024 | 5.52384870 |
| 2 | 3p | 3.470283 | -6.55770307 |
| 3 | 4p | 2.705003 | 7.62177972 |
| 4 | 5p | 2.766548 | -7.93389600 |
| 5 | 2p | 12.266201 | .01813686 |
| 6 | 5p | 19.209453 | .00083228 |
| 7 | 4p | 38.544094 | -.00015615 |
| 8 | 5p | 1.325245 | -.02664616 |
| 9 | 4p | 1.162066 | .02887445 |
| ORB.ENERGY,a.u. | -3.995600 | ||
| NORM | 1.000000 | < R > | 2.560048 | < R2 > | 7.379002 | < 1/R > | .570975 | < 1/R**2 > | 1.118344 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.861477 | .43414093 |
| 2 | 2s | 7.408005 | -.81595690 |
| 3 | 3s | 8.979239 | -.30366314 |
| 4 | 5s | 14.852119 | -.01968317 |
| 5 | 4s | 29.460652 | .00614596 |
| 6 | 5s | 38.369528 | -.00158961 |
| 7 | 3s | 66.063673 | .00005899 |
| 8 | 5s | 2.194913 | .00129631 |
| 9 | 4s | 1.852391 | -.00126278 |
| ORB.ENERGY,a.u. | -29.199000 | ||
| NORM | 1.000000 | < R > | .381439 | < R2 > | .169683 | < 1/R > | 3.875086 | < 1/R**2 > | 60.475085 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.395384 | .93922500 |
| 2 | 1s | 25.860771 | .04801396 |
| 3 | 2s | 20.295375 | .01680341 |
| 4 | 3s | 12.489115 | .00145480 |
| 5 | 4s | 67.873264 | -.00041857 |
| 6 | 5s | 90.414722 | .00015341 |
| 7 | 5s | 8.473979 | .00010503 |
| ORB.ENERGY,a.u. | -128.100000 |
| NORM | 1.000000 | < R > | .090343 | < R2 > | .010920 | < 1/R > | 16.673330 | < 1/R**2 > | 558.940496 |
Total Energy= -312.09470009 a.u.
Kinetic Energy= 312.08553941 a.u.
Potential Energy= -624.18023950 a.u.
Virial Ratio = -2.00002935