(1s 2 2s 2 2p 5 4p 1 ) 1 P Cl 7+
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 | 8.206442 | .18595901 |
| 2 | 3p | 1.740919 | 2.13034133 |
| 3 | 4p | 3.304627 | -1.54162481 |
| 4 | 5p | 5.957968 | -.16613394 |
| 5 | 3p | 16.092890 | -.00263163 |
| 6 | 5p | 1.621107 | -.27191026 |
| 7 | 4p | 1.153224 | .15071566 |
| 8 | 3p | .734839 | -.07312474 |
| 9 | 4p | .707165 | .02080323 |
| 10 | 3p | 73.134460 | .00000608 |
| ORB.ENERGY,a.u. | -2.353400 | ||
| NORM | 1.000000 | < R > | 2.442572 | < R2 > | 6.747680 | < 1/R > | .576988 | < 1/R**2 > | .974812 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 5.873196 | 1.18986793 |
| 2 | 3p | 6.923718 | -.25684567 |
| 3 | 2p | 13.020869 | .06652274 |
| 4 | 4p | 15.738861 | .00930953 |
| 5 | 5p | 40.316642 | -.00013618 |
| 6 | 5p | 3.564247 | .00033653 |
| ORB.ENERGY,a.u. | -14.097000 | ||
| NORM | 1.000000 | < R > | .387217 | < R2 > | .184268 | < 1/R > | 3.322409 | < 1/R**2 > | 15.233782 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.585687 | .39248196 |
| 2 | 2s | 7.176108 | -.84167960 |
| 3 | 3s | 6.564886 | -.30363137 |
| 4 | 4s | 11.936008 | .00249037 |
| 5 | 3s | 16.931103 | .01144826 |
| 6 | 5s | 35.791392 | .00073694 |
| 7 | 5s | 6.591625 | -.00953732 |
| 8 | 4s | 2.297428 | .00017726 |
| 9 | 3s | 66.760537 | -.00003448 |
| ORB.ENERGY,a.u. | -15.351000 | ||
| NORM | 1.000000 | < R > | .429734 | < R2 > | .217741 | < 1/R > | 3.406120 | < 1/R**2 > | 47.528675 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.183121 | .92724830 |
| 2 | 1s | 23.747611 | .06858115 |
| 3 | 2s | 10.166858 | .02127976 |
| 4 | 3s | 12.550848 | -.02162127 |
| 5 | 4s | 15.509374 | .01070531 |
| 6 | 5s | 40.686172 | .00065972 |
| 7 | 4s | 89.402988 | -.00003857 |
| ORB.ENERGY,a.u. | -109.540000 |
| NORM | 1.000000 | < R > | .091159 | < R2 > | .011159 | < 1/R > | 16.575457 | < 1/R**2 > | 553.797494 |
Total Energy= -434.36517611 a.u.
Kinetic Energy= 434.35733091 a.u.
Potential Energy= -868.72250702 a.u.
Virial Ratio = -2.00001806