(1s 2 2s 2 2p 5 3d 1 ) 1 D Ar 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1232.
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 | 3d- electron | |
| 1 | 3d | 3.160673 | 1.12989641 |
| 2 | 3d | 8.070383 | .03755293 |
| 3 | 4d | 3.915893 | -.15089091 |
| 4 | 4d | 47.230621 | .00001661 |
| 5 | 5d | 2.426935 | .00254681 |
| 6 | 4d | 1.717138 | -.00052286 |
| 7 | 4d | 33.006224 | -.00001684 |
| ORB.ENERGY,a.u. | -4.692500 | ||
| NORM | 1.000000 | < R > | 1.083067 | < R2 > | 1.357633 | < 1/R > | 1.097939 | < 1/R**2 > | 1.489316 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.302224 | 1.18810659 |
| 2 | 3p | 7.350463 | -.25731076 |
| 3 | 2p | 13.746167 | .06735617 |
| 4 | 4p | 16.735413 | .00883618 |
| 5 | 5p | 4.978208 | .00123918 |
| 6 | 5p | 42.700812 | -.00013182 |
| ORB.ENERGY,a.u. | -16.344000 | ||
| NORM | 1.000000 | < R > | .359911 | < R2 > | .159075 | < 1/R > | 3.569709 | < 1/R**2 > | 17.552242 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.295229 | .40141404 |
| 2 | 2s | 7.699452 | -.84681487 |
| 3 | 3s | 6.993934 | -.30673826 |
| 4 | 4s | 18.501136 | .00455306 |
| 5 | 3s | 19.584168 | .00698017 |
| 6 | 5s | 36.405603 | .00107794 |
| 7 | 5s | 6.503604 | -.00519950 |
| 8 | 4s | 43.616922 | .00029714 |
| ORB.ENERGY,a.u. | -18.309000 | ||
| NORM | 1.000000 | < R > | .401551 | < R2 > | .190040 | < 1/R > | 3.650594 | < 1/R**2 > | 54.560645 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.191113 | .93052783 |
| 2 | 1s | 25.174341 | .06482628 |
| 3 | 2s | 10.858538 | .02184722 |
| 4 | 3s | 13.394006 | -.02196617 |
| 5 | 4s | 16.618126 | .01065556 |
| 6 | 5s | 43.099929 | .00068936 |
| 7 | 4s | 98.531443 | -.00003129 |
| ORB.ENERGY,a.u. | -124.690000 |
| NORM | 1.000000 | < R > | .085953 | < R2 > | .009917 | < 1/R > | 17.572969 | < 1/R**2 > | 622.215019 |
Total Energy= -495.21308248 a.u.
Kinetic Energy= 495.17240867 a.u.
Potential Energy= -990.38549115 a.u.
Virial Ratio = -2.00008214