(1s 2 2s 2 2p 4 5s 1 ) 2 P Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2150.
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 | 5s- electron | |
1 | 1s | 14.252421 | .07434198 |
2 | 2s | 4.939034 | -.48026826 |
3 | 3s | 2.659378 | 3.12219264 |
4 | 4s | 2.433541 | -5.72124636 |
5 | 5s | 2.150664 | 3.55497850 |
6 | 5s | 18.603119 | -.00363016 |
7 | 4s | 24.017022 | -.00098357 |
8 | 5s | 39.965454 | .00016555 |
ORB.ENERGY,a.u. | -2.323900 |
NORM | 1.000004 | < R > | 3.240787 | < R2 > | 11.753279 | < 1/R > | .442882 | < 1/R**2 > | 1.916299 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2p- electron | |
1 | 2p | 6.506539 | 1.12765980 |
2 | 3p | 7.258624 | -.20430238 |
3 | 2p | 13.752631 | .07157772 |
4 | 4p | 16.508860 | .01284819 |
5 | 5p | 20.301700 | -.00057855 |
6 | 5p | 6.315861 | -.00131563 |
7 | 4p | 72.090475 | .00002303 |
ORB.ENERGY,a.u. | -19.317000 |
NORM | 1.000000 | < R > | .347882 | < R2 > | .147747 | < 1/R > | 3.669787 | < 1/R**2 > | 18.427451 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2s- electron | |
1 | 1s | 15.449411 | .36547420 |
2 | 2s | 6.899783 | -.78259472 |
3 | 3s | 9.821241 | -.24117984 |
4 | 4s | 7.816817 | -.07005233 |
5 | 5s | 21.137894 | -.00798393 |
6 | 5s | 3.098049 | -.00886633 |
7 | 3s | 3.395856 | .00453251 |
8 | 3s | 65.238266 | -.00007490 |
9 | 4s | 116.630735 | .00001319 |
10 | 4s | 1.792479 | .00690890 |
ORB.ENERGY,a.u. | -20.023000 |
NORM | 1.000000 | < R > | .392814 | < R2 > | .181422 | < 1/R > | 3.734694 | < 1/R**2 > | 56.898266 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 17.133350 | .92065570 |
2 | 1s | 24.676720 | .07565784 |
3 | 2s | 11.575531 | .02021313 |
4 | 3s | 13.985286 | -.01977030 |
5 | 4s | 16.499562 | .00848524 |
6 | 5s | 44.494943 | .00057576 |
7 | 3s | 63.277996 | -.00007681 |
8 | 5s | 1.875324 | -.00544438 |
9 | 4s | 1.672196 | .00644710 |
10 | 3s | 1.846083 | -.00135805 |
ORB.ENERGY,a.u. | -127.520000 |
NORM | 1.000000 | < R > | .085844 | < R2 > | .009887 | < 1/R > | 17.587025 | < 1/R**2 > | 622.983236 |
Total Energy= -475.24422779 a.u.
Kinetic Energy= 475.23442316 a.u.
Potential Energy= -950.47865096 a.u.
Virial Ratio = -2.00002063