(1s 2 2p 1 ) 2 P Na 8+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2121.
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 | 2p- electron | |
| 1 | 2p | 4.562427 | .97530532 |
| 2 | 2p | 10.452366 | .01424941 |
| 3 | 2p | 13.164827 | .00518564 |
| 4 | 3p | 7.611791 | .01651214 |
| 5 | 4p | 7.600911 | -.00349894 |
| 6 | 5p | 24.688014 | -.00022851 |
| ORB.ENERGY,a.u. | -10.347000 | ||
| NORM | 1.000000 | < R > | .540577 | < R2 > | .352087 | < 1/R > | 2.327191 | < 1/R**2 > | 7.297319 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.444986 | .94290665 |
| 2 | 1s | 17.664577 | .04694524 |
| 3 | 2s | 13.266835 | .01501288 |
| 4 | 3s | 9.259018 | .00477239 |
| 5 | 4s | 21.321107 | -.00293541 |
| 6 | 5s | 25.659665 | .00103831 |
| 7 | 3s | 30.992719 | -.00067794 |
| ORB.ENERGY,a.u. | -51.427000 |
| NORM | 1.000000 | < R > | .141667 | < R2 > | .026917 | < 1/R > | 10.664100 | < 1/R**2 > | 229.442053 |
Total Energy= -124.57647716 a.u.
Kinetic Energy= 124.57647011 a.u.
Potential Energy= -249.15294728 a.u.
Virial Ratio = -2.00000006