(1s 2 2s 2 2p 1 5p 1 ) 1 S F 3+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1051.
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 | 1.809880 | .24103398 |
| 2 | 3p | 1.092418 | -2.20724328 |
| 3 | 4p | .905515 | 5.25309163 |
| 4 | 5p | .840431 | -3.95716816 |
| 5 | 2p | 5.416752 | .01948490 |
| 6 | 5p | 3.839160 | .01012287 |
| 7 | 3p | 11.214804 | -.00046663 |
| ORB.ENERGY,a.u. | -.352670 | ||
| NORM | 1.000001 | < R > | 8.260021 | < R2 > | 76.633931 | < 1/R > | .161179 | < 1/R**2 > | .059883 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.108880 | .90941484 |
| 2 | 2p | 5.817894 | .11000477 |
| 3 | 2p | 15.598265 | .00093209 |
| 4 | 5p | 1.159185 | .22093138 |
| 5 | 4p | .587458 | -.06304635 |
| 6 | 5p | 7.626878 | .00920637 |
| 7 | 3p | .697700 | -.20105200 |
| 8 | 4p | 13.958182 | -.00173076 |
| 9 | 3p | .456310 | .03429448 |
| ORB.ENERGY,a.u. | -4.006000 | ||
| NORM | 1.000000 | < R > | .775042 | < R2 > | .897429 | < 1/R > | 1.681264 | < 1/R**2 > | 3.872647 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.079782 | .30806210 |
| 2 | 2s | 2.896698 | -.78795124 |
| 3 | 3s | 4.663925 | -.27108253 |
| 4 | 4s | 16.409930 | .00240933 |
| 5 | 5s | 9.231155 | -.01709296 |
| 6 | 5s | 3.314145 | .02578095 |
| 7 | 4s | 34.160166 | .00004365 |
| ORB.ENERGY,a.u. | -4.533500 | ||
| NORM | 1.000000 | < R > | .843697 | < R2 > | .836812 | < 1/R > | 1.710791 | < 1/R**2 > | 11.859028 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.455611 | .00132239 |
| 2 | 1s | 8.053519 | .85101404 |
| 3 | 1s | 12.611402 | .14431918 |
| 4 | 2s | 11.017717 | .02090533 |
| 5 | 3s | 9.823106 | -.01578801 |
| 6 | 4s | 15.761135 | .00481293 |
| 7 | 5s | 28.853814 | .00027672 |
| ORB.ENERGY,a.u. | -30.269000 |
| NORM | 1.000000 | < R > | .174839 | < R2 > | .041070 | < 1/R > | 8.657178 | < 1/R**2 > | 151.542495 |
Total Energy= -92.48845568 a.u.
Kinetic Energy= 92.47940644 a.u.
Potential Energy= -184.96786212 a.u.
Virial Ratio = -2.00009785