(1s 2 2s 2 2p 5 4p 1 ) 1 S Cl 7+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1041.
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 | 7.841738 | .15707169 |
| 2 | 3p | 1.743221 | 2.41567521 |
| 3 | 4p | 3.103393 | -1.85349009 |
| 4 | 5p | 5.487359 | -.19184293 |
| 5 | 3p | 11.727735 | -.01207291 |
| 6 | 5p | 1.660464 | -.16688205 |
| 7 | 4p | 1.052661 | .06179477 |
| 8 | 5p | 23.447698 | .00045648 |
| 9 | 3p | .869193 | -.04932211 |
| ORB.ENERGY,a.u. | -2.261900 | ||
| NORM | 1.000000 | < R > | 2.548327 | < R2 > | 7.327162 | < 1/R > | .527468 | < 1/R**2 > | .696410 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.085932 | 1.19256449 |
| 2 | 3p | 7.727310 | -.25910804 |
| 3 | 2p | 12.953833 | .05204135 |
| 4 | 4p | 11.215971 | .02213572 |
| 5 | 5p | 2.379571 | .04844527 |
| 6 | 4p | 2.190286 | -.03708294 |
| 7 | 5p | 21.480502 | .00308235 |
| 8 | 3p | 1.098354 | .00054598 |
| 9 | 3p | 26.665958 | -.00012190 |
| ORB.ENERGY,a.u. | -14.006000 | ||
| NORM | 1.000000 | < R > | .386255 | < R2 > | .184252 | < 1/R > | 3.329226 | < 1/R**2 > | 15.281083 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.589222 | .39236006 |
| 2 | 2s | 7.170278 | -.84328543 |
| 3 | 3s | 6.473935 | -.30560396 |
| 4 | 4s | 17.758337 | .00384736 |
| 5 | 3s | 19.165975 | .00758609 |
| 6 | 5s | 35.506462 | .00065175 |
| 7 | 5s | 5.333353 | -.00301316 |
| 8 | 4s | 3.685054 | .00101896 |
| 9 | 3s | 58.144608 | -.00004438 |
| ORB.ENERGY,a.u. | -15.351000 | ||
| NORM | 1.000000 | < R > | .429695 | < R2 > | .217695 | < 1/R > | 3.406385 | < 1/R**2 > | 47.535151 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.183144 | .92723630 |
| 2 | 1s | 23.746815 | .06859250 |
| 3 | 2s | 10.171717 | .02127064 |
| 4 | 3s | 12.556940 | -.02160787 |
| 5 | 4s | 15.509153 | .01070416 |
| 6 | 5s | 40.681333 | .00066088 |
| 7 | 4s | 89.506686 | -.00003857 |
| ORB.ENERGY,a.u. | -109.540000 |
| NORM | 1.000000 | < R > | .091158 | < R2 > | .011159 | < 1/R > | 16.575519 | < 1/R**2 > | 553.801075 |
Total Energy= -434.34313807 a.u.
Kinetic Energy= 434.26627910 a.u.
Potential Energy= -868.60941717 a.u.
Virial Ratio = -2.00017699