(1s 2 2s 2 2p 2 4p 1 ) 4 D Ar 11+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4241.
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 | 8.340190 | .29398750 |
| 2 | 3p | 3.041954 | -.75710013 |
| 3 | 5p | 3.318443 | 1.41889672 |
| 4 | 4p | 4.785322 | -.63187087 |
| 5 | 5p | 11.243133 | .02244750 |
| 6 | 4p | 28.094453 | -.00160724 |
| 7 | 5p | 4.081328 | .39580077 |
| 8 | 5p | 66.288865 | -.00011248 |
| 9 | 4p | 101.352837 | -.00002246 |
| ORB.ENERGY,a.u. | -4.917000 | ||
| NORM | .999999 | < R > | 1.757850 | < R2 > | 3.496878 | < 1/R > | .809028 | < 1/R**2 > | 1.828451 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.189756 | 1.15231333 |
| 2 | 3p | 8.264500 | -.17586851 |
| 3 | 2p | 16.760690 | .02155721 |
| 4 | 4p | 18.418150 | .00469869 |
| 5 | 5p | 40.275753 | -.00022445 |
| 6 | 5p | 7.724447 | -.00472669 |
| 7 | 4p | 2.487222 | -.00037142 |
| ORB.ENERGY,a.u. | -24.698000 | ||
| NORM | 1.000000 | < R > | .328399 | < R2 > | .130696 | < 1/R > | 3.853844 | < 1/R**2 > | 20.121190 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.022785 | .43913516 |
| 2 | 2s | 8.019243 | -.87221925 |
| 3 | 3s | 8.243473 | -.28677654 |
| 4 | 4s | 30.827782 | .00188934 |
| 5 | 3s | 16.046453 | .01939224 |
| 6 | 5s | 8.360829 | -.02609558 |
| 7 | 4s | 2.562744 | .00013943 |
| ORB.ENERGY,a.u. | -23.662000 | ||
| NORM | 1.000000 | < R > | .378801 | < R2 > | .168041 | < 1/R > | 3.881036 | < 1/R**2 > | 61.060558 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.066729 | .92685551 |
| 2 | 1s | 25.716094 | .07170678 |
| 3 | 2s | 15.723154 | .01939434 |
| 4 | 3s | 19.688270 | -.01554985 |
| 5 | 5s | 42.259946 | .00078014 |
| 6 | 4s | 99.815834 | -.00003435 |
| 7 | 5s | 13.007205 | .00019594 |
| ORB.ENERGY,a.u. | -133.590000 |
| NORM | 1.000000 | < R > | .085574 | < R2 > | .009810 | < 1/R > | 17.622468 | < 1/R**2 > | 624.934053 |
Total Energy= -435.27664748 a.u.
Kinetic Energy= 435.30875606 a.u.
Potential Energy= -870.58540353 a.u.
Virial Ratio = -1.99992624