(1s 1 4p 1 ) 1 P Mg 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1141.
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 | 4p- electron | |
1 | 2p | 5.304107 | .44215337 |
2 | 3p | 2.421015 | -1.07295266 |
3 | 5p | 2.919170 | 1.94234090 |
4 | 4p | 4.041050 | -.66929076 |
5 | 5p | 8.968712 | .00909641 |
6 | 4p | 21.049813 | -.00175829 |
7 | 5p | 2.464823 | .11039253 |
8 | 5p | 42.402863 | -.00009564 |
9 | 3p | 34.744017 | -.00016395 |
ORB.ENERGY,a.u. | -3.912600 |
NORM | 1.000000 | < R > | 2.095982 | < R2 > | 4.983389 | < 1/R > | .686414 | < 1/R**2 > | 1.258085 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 11.745381 | .88929787 |
2 | 1s | 14.405275 | .10559758 |
3 | 2s | 14.313071 | .01067253 |
4 | 3s | 12.286022 | -.00523244 |
5 | 4s | 37.651144 | .00000754 |
6 | 5s | 8.169860 | .00009774 |
ORB.ENERGY,a.u. | -71.413000 |
NORM | 1.000000 | < R > | .125002 | < R2 > | .020836 | < 1/R > | 12.000205 | < 1/R**2 > | 288.013108 |
Total Energy= -75.79917525 a.u.
Kinetic Energy= 75.77177065 a.u.
Potential Energy= -151.57094590 a.u.
Virial Ratio = -2.00036167