(1s 2 2s 2 2p 2 4p 1 ) 4 P Cl 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4141.
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 | 7.884503 | .28201076 |
| 2 | 3p | 2.757276 | -.73715417 |
| 3 | 5p | 3.045277 | 1.41734266 |
| 4 | 4p | 4.402354 | -.64683933 |
| 5 | 5p | 10.538547 | .02309356 |
| 6 | 4p | 26.818623 | -.00161225 |
| 7 | 5p | 3.757687 | .40228402 |
| 8 | 5p | 65.072982 | -.00010549 |
| 9 | 4p | 101.260711 | -.00001950 |
| ORB.ENERGY,a.u. | -4.143100 | ||
| NORM | .999999 | < R > | 1.911082 | < R2 > | 4.132441 | < 1/R > | .743129 | < 1/R**2 > | 1.547226 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.773930 | 1.12429036 |
| 2 | 3p | 7.821157 | -.15025581 |
| 3 | 2p | 16.151052 | .02184532 |
| 4 | 4p | 18.803703 | .00738359 |
| 5 | 5p | 27.444449 | -.00117956 |
| 6 | 5p | 3.253015 | -.00052184 |
| 7 | 4p | 73.777094 | .00003093 |
| ORB.ENERGY,a.u. | -65.131000 | ||
| NORM | 1.000000 | < R > | .351571 | < R2 > | .149898 | < 1/R > | 3.603045 | < 1/R**2 > | 17.607237 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.295586 | .43215883 |
| 2 | 2s | 7.512971 | -.86882176 |
| 3 | 3s | 7.674744 | -.28612501 |
| 4 | 4s | 29.049025 | .00197714 |
| 5 | 3s | 15.228311 | .01989488 |
| 6 | 5s | 7.789398 | -.02586120 |
| 7 | 4s | 2.390888 | .00015093 |
| ORB.ENERGY,a.u. | -20.297000 | ||
| NORM | 1.000000 | < R > | .404376 | < R2 > | .191568 | < 1/R > | 3.631175 | < 1/R**2 > | 53.480845 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.059577 | .92146066 |
| 2 | 1s | 24.150965 | .07730350 |
| 3 | 2s | 14.978602 | .01930977 |
| 4 | 3s | 18.604916 | -.01561077 |
| 5 | 5s | 40.316188 | .00085062 |
| 6 | 4s | 97.389969 | -.00003129 |
| 7 | 5s | 12.948157 | .00029826 |
| ORB.ENERGY,a.u. | -117.740000 |
| NORM | 1.000000 | < R > | .090741 | < R2 > | .011034 | < 1/R > | 16.623829 | < 1/R**2 > | 556.302509 |
Total Energy= -385.28724737 a.u.
Kinetic Energy= 385.30188086 a.u.
Potential Energy= -770.58912823 a.u.
Virial Ratio = -1.99996202