(1s 1 3p 1 ) 1 P He 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1131.
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 | 3p- electron | |
1 | 3p | .314380 | -2.88647335 |
2 | 2p | .276110 | 2.39305182 |
3 | 4p | .450468 | -.18843191 |
4 | 3p | 2.292914 | -.00455982 |
5 | 2p | 3.791244 | .00033419 |
ORB.ENERGY,a.u. | -.054846 |
NORM | .999990 | < R > | 12.710732 | < R2 > | 185.881635 | < 1/R > | .108452 | < 1/R**2 > | .023005 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 1.944525 | .75325530 |
2 | 1s | 2.096038 | .25936069 |
3 | 2s | 1.902144 | -.01319831 |
4 | 3s | 1.620889 | -.00160140 |
5 | 4s | 3.365855 | -.00032807 |
ORB.ENERGY,a.u. | -1.832600 |
NORM | 1.000000 | < R > | .749458 | < R2 > | .748631 | < 1/R > | 2.000890 | < 1/R**2 > | 8.005512 |
Total Energy= -2.05629987 a.u.
Kinetic Energy= 2.05473912 a.u.
Potential Energy= -4.11103900 a.u.
Virial Ratio = -2.00075958