(1s 2 2s 2 2p 1 4d 1 ) 3 P Ar 12+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3142.
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 | 4d- electron | |
| 1 | 3d | 3.764053 | 1.31431938 |
| 2 | 4d | 3.237100 | -1.81840445 |
| 3 | 3d | 8.302480 | .03336020 |
| 4 | 5d | 26.744608 | -.00028762 |
| 5 | 4d | 7.518953 | .00022470 |
| 6 | 5d | 2.454169 | .01239659 |
| 7 | 3d | 1.861794 | -.01209371 |
| 8 | 5d | 11.659996 | -.00306958 |
| ORB.ENERGY,a.u. | -5.387000 | ||
| NORM | 1.000000 | < R > | 1.577029 | < R2 > | 2.847314 | < 1/R > | .839700 | < 1/R**2 > | 1.154484 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 7.621086 | 1.08464299 |
| 2 | 3p | 9.210730 | -.09618015 |
| 3 | 2p | 18.677008 | .01110178 |
| 4 | 5p | 23.110153 | .00235336 |
| 5 | 4p | 3.229757 | -.00014101 |
| ORB.ENERGY,a.u. | -26.879000 | ||
| NORM | 1.000000 | < R > | .320456 | < R2 > | .124111 | < 1/R > | 3.936880 | < 1/R**2 > | 20.920868 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 15.376918 | .39009586 |
| 2 | 2s | 7.024669 | -.81684356 |
| 3 | 3s | 10.040605 | -.28717010 |
| 4 | 4s | 33.201680 | .00119217 |
| 5 | 5s | 19.599717 | -.00809227 |
| 6 | 5s | 7.739158 | .01683461 |
| ORB.ENERGY,a.u. | -26.841000 | ||
| NORM | 1.000000 | < R > | .371794 | < R2 > | .161637 | < 1/R > | 3.959430 | < 1/R**2 > | 63.334802 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.203057 | .93905753 |
| 2 | 1s | 26.401276 | .05739306 |
| 3 | 2s | 15.898252 | .02016554 |
| 4 | 3s | 19.392191 | -.01418620 |
| 5 | 4s | 86.758071 | -.00006083 |
| 6 | 5s | 41.411616 | .00061780 |
| 7 | 5s | 10.350270 | .00004461 |
| ORB.ENERGY,a.u. | -137.760000 |
| NORM | 1.000000 | < R > | .085399 | < R2 > | .009762 | < 1/R > | 17.646008 | < 1/R**2 > | 626.240451 |
Total Energy= -410.61539728 a.u.
Kinetic Energy= 410.59693792 a.u.
Potential Energy= -821.21233519 a.u.
Virial Ratio = -2.00004496