(1s 2 2s 2 2p 2 4s 1 ) 4 P Cl 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4140.
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 | 4s- electron | |
| 1 | 1s | 13.197365 | .12843363 |
| 2 | 2s | 3.761509 | -1.48014015 |
| 3 | 3s | 3.367299 | 3.77527203 |
| 4 | 4s | 2.977547 | -2.78376683 |
| 5 | 5s | 4.575833 | -.22705107 |
| 6 | 4s | 13.218031 | -.01609343 |
| 7 | 5s | 38.409590 | .00025675 |
| 8 | 5s | 1.960448 | -.00099157 |
| ORB.ENERGY,a.u. | -4.368200 | ||
| NORM | 1.000001 | < R > | 1.900731 | < R2 > | 4.058563 | < 1/R > | .763309 | < 1/R**2 > | 4.708336 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.764859 | 1.13025832 |
| 2 | 3p | 7.798406 | -.15527683 |
| 3 | 2p | 16.239548 | .02112219 |
| 4 | 4p | 18.890780 | .00647189 |
| 5 | 5p | 28.133225 | -.00094373 |
| 6 | 5p | 4.698490 | -.00047999 |
| 7 | 4p | 74.798804 | .00002674 |
| ORB.ENERGY,a.u. | -21.100000 | ||
| NORM | 1.000000 | < R > | .351737 | < R2 > | .150032 | < 1/R > | 3.601136 | < 1/R**2 > | 17.587978 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.096737 | .44213839 |
| 2 | 2s | 7.588206 | -.89310191 |
| 3 | 3s | 7.273141 | -.29594071 |
| 4 | 4s | 29.035163 | .00199605 |
| 5 | 3s | 15.066735 | .02292408 |
| 6 | 5s | 5.588362 | -.00527640 |
| 7 | 4s | 2.763445 | .00472816 |
| ORB.ENERGY,a.u. | -20.297000 | ||
| NORM | 1.000000 | < R > | .404340 | < R2 > | .191546 | < 1/R > | 3.631842 | < 1/R**2 > | 53.502208 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.057810 | .91964736 |
| 2 | 1s | 23.916091 | .07957167 |
| 3 | 2s | 14.100692 | .01951488 |
| 4 | 3s | 17.845459 | -.01611382 |
| 5 | 5s | 40.392933 | .00071070 |
| 6 | 4s | 89.267324 | -.00004174 |
| 7 | 5s | 6.411436 | .00032664 |
| 8 | 3s | 2.066776 | -.00033315 |
| ORB.ENERGY,a.u. | -117.740000 |
| NORM | 1.000000 | < R > | .090729 | < R2 > | .011031 | < 1/R > | 16.625303 | < 1/R**2 > | 556.378123 |
Total Energy= -385.50806240 a.u.
Kinetic Energy= 385.52080346 a.u.
Potential Energy= -771.02886587 a.u.
Virial Ratio = -1.99996695