(1s 2 2s 2 2p 4 3s 1 ) 4 P Ar 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4130.
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 | 3s- electron | |
1 | 1s | 14.284598 | .18387849 |
2 | 2s | 5.640431 | -.85004096 |
3 | 3s | 3.860560 | 1.38815984 |
4 | 4s | 14.405591 | -.01810474 |
5 | 5s | 3.076148 | -.00920486 |
6 | 5s | 56.310457 | -.00008963 |
7 | 4s | 36.139127 | .00046720 |
8 | 5s | 2.452221 | .00650747 |
9 | 4s | 1.865564 | -.00275515 |
10 | 2s | 69.301893 | .00000990 |
ORB.ENERGY,a.u. | -7.350800 |
NORM | 1.000000 | < R > | 1.035375 | < R2 > | 1.216230 | < 1/R > | 1.380850 | < 1/R**2 > | 11.636950 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2p- electron | |
1 | 2p | 6.500080 | 1.13266230 |
2 | 3p | 7.279991 | -.20966784 |
3 | 2p | 13.652852 | .07161969 |
4 | 4p | 16.058501 | .01092358 |
5 | 5p | 46.112825 | -.00012067 |
6 | 5p | 6.115847 | .00147478 |
ORB.ENERGY,a.u. | -18.610000 |
NORM | 1.000000 | < R > | .348960 | < R2 > | .148807 | < 1/R > | 3.661115 | < 1/R**2 > | 18.350480 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2s- electron | |
1 | 1s | 15.626174 | .35762619 |
2 | 2s | 6.498753 | -.84358319 |
3 | 3s | 9.907397 | -.23512310 |
4 | 4s | 4.062896 | -.03732261 |
5 | 5s | 21.283288 | -.01008943 |
6 | 4s | 28.764326 | -.00111589 |
7 | 3s | 3.495698 | .03916842 |
8 | 4s | 2.611376 | -.00062722 |
9 | 5s | 78.148469 | -.00002976 |
10 | 3s | 56.790909 | -.00007685 |
ORB.ENERGY,a.u. | -20.023000 |
NORM | 1.000000 | < R > | .395180 | < R2 > | .183999 | < 1/R > | 3.716015 | < 1/R**2 > | 56.404560 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 17.132968 | .91948929 |
2 | 1s | 24.650533 | .07648284 |
3 | 2s | 12.089667 | .01958676 |
4 | 3s | 14.431887 | -.01873454 |
5 | 4s | 16.831764 | .00829534 |
6 | 5s | 44.060717 | .00066980 |
7 | 4s | 4.551324 | .00042728 |
8 | 3s | 68.649935 | -.00006349 |
ORB.ENERGY,a.u. | -127.520000 |
NORM | 1.000000 | < R > | .085838 | < R2 > | .009885 | < 1/R > | 17.587626 | < 1/R**2 > | 623.009337 |
Total Energy= -480.20367131 a.u.
Kinetic Energy= 480.24092526 a.u.
Potential Energy= -960.44459657 a.u.
Virial Ratio = -1.99992243