(1s 2 2s 2 2p 5 5p 1 ) 1 D Ar 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1251.
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 | 5.016449 | .23373719 |
| 2 | 3p | 2.481059 | -2.08274041 |
| 3 | 4p | 2.075958 | 5.08457742 |
| 4 | 5p | 1.928366 | -3.71394216 |
| 5 | 5p | 17.656466 | .00121360 |
| 6 | 2p | 10.673730 | .04768637 |
| 7 | 5p | 1.719207 | -.13657748 |
| 8 | 4p | 39.677055 | -.00010130 |
| ORB.ENERGY,a.u. | -1.822300 | ||
| NORM | 1.000003 | < R > | 3.607073 | < R2 > | 14.630125 | < 1/R > | .398983 | < 1/R**2 > | .582752 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.383727 | 1.17251935 |
| 2 | 3p | 7.505928 | -.23470711 |
| 3 | 2p | 14.049434 | .06114345 |
| 4 | 4p | 17.216242 | .00927217 |
| 5 | 4p | 1.862478 | .00158422 |
| 6 | 5p | 1.858995 | -.00158486 |
| 7 | 4p | 67.238734 | .00002630 |
| ORB.ENERGY,a.u. | -17.178000 | ||
| NORM | 1.000000 | < R > | .358883 | < R2 > | .157964 | < 1/R > | 3.576144 | < 1/R**2 > | 17.601439 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 14.335921 | .40034632 |
| 2 | 2s | 7.681910 | -.84666087 |
| 3 | 3s | 7.016315 | -.30622328 |
| 4 | 4s | 18.787110 | .00511264 |
| 5 | 3s | 21.334677 | .00697170 |
| 6 | 5s | 37.834633 | .00057040 |
| 7 | 5s | 5.990379 | -.00345420 |
| 8 | 4s | 3.990844 | .00175509 |
| 9 | 3s | 2.785337 | -.00065617 |
| 10 | 2s | 92.912309 | .00000766 |
| ORB.ENERGY,a.u. | -18.309000 | ||
| NORM | 1.000000 | < R > | .400759 | < R2 > | .189159 | < 1/R > | 3.656817 | < 1/R**2 > | 54.726072 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 17.190273 | .93053568 |
| 2 | 1s | 25.176353 | .06482481 |
| 3 | 2s | 10.844054 | .02187876 |
| 4 | 3s | 13.382890 | -.02198447 |
| 5 | 4s | 16.613759 | .01066289 |
| 6 | 5s | 42.652499 | .00068231 |
| 7 | 4s | 99.728039 | -.00003414 |
| ORB.ENERGY,a.u. | -124.690000 |
| NORM | 1.000000 | < R > | .085959 | < R2 > | .009919 | < 1/R > | 17.572097 | < 1/R**2 > | 622.165661 |
Total Energy= -492.30317951 a.u.
Kinetic Energy= 492.30050739 a.u.
Potential Energy= -984.60368690 a.u.
Virial Ratio = -2.00000543