(1s 2 ) 1 S Be 2+
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 | 3.140334 | .55213442 |
2 | 1s | 4.128334 | .50950927 |
3 | 2s | 5.348489 | -.05545189 |
4 | 3s | 3.164166 | -.00906050 |
5 | 4s | 6.701910 | .00598502 |
6 | 5s | 22.685198 | -.00011395 |
7 | 3s | 65.799470 | .00000371 |
ORB.ENERGY,a.u. | -5.613300 |
NORM | 1.000000 | < R > | .414141 | < R2 > | .231830 | < 1/R > | 3.687458 | < 1/R**2 > | 27.824650 |
Total Energy= -13.61129947 a.u.
Kinetic Energy= 13.61129944 a.u.
Potential Energy= -27.22259891 a.u.
Virial Ratio = -2.00000000