(1s 2 ) 1 S Ne 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1010.
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 | 1s- electron | |
1 | 1s | 8.260109 | .38269213 |
2 | 1s | 10.090301 | .67049593 |
3 | 2s | 12.699327 | -.04179713 |
4 | 3s | 9.156821 | -.01854635 |
5 | 4s | 18.412622 | .00248745 |
6 | 5s | 38.758874 | .00002273 |
7 | 3s | 27.485063 | -.00022646 |
ORB.ENERGY,a.u. | -43.970000 |
NORM | 1.000000 | < R > | .155862 | < R2 > | .032552 | < 1/R > | 9.687494 | < 1/R**2 > | 189.312805 |
Total Energy= -93.86111322 a.u.
Kinetic Energy= 93.86111395 a.u.
Potential Energy= -187.72222718 a.u.
Virial Ratio = -1.99999999