(1s 1 4p 1 ) 3 P Be 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3141.
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 | .472556 | .83574655 |
| 2 | 2p | 1.098727 | .78221424 |
| 3 | 3p | .837373 | -3.08187797 |
| 4 | 4p | .707179 | 2.48897262 |
| 5 | 5p | .658805 | -.47372489 |
| 6 | 2p | 3.335892 | .01620794 |
| 7 | 5p | 8.390893 | .00042881 |
| 8 | 4p | 5.970394 | -.00227991 |
| ORB.ENERGY,a.u. | -.288670 | ||
| NORM | 1.000000 | < R > | 7.507161 | < R2 > | 63.955762 | < 1/R > | .192981 | < 1/R**2 > | .103811 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.914817 | .75855914 |
| 2 | 1s | 4.102083 | .25505036 |
| 3 | 2s | 4.054789 | -.01486306 |
| 4 | 3s | 4.985472 | -.00056621 |
| 5 | 4s | 2.049271 | -.00023268 |
| ORB.ENERGY,a.u. | -7.788700 |
| NORM | 1.000000 | < R > | .375372 | < R2 > | .187922 | < 1/R > | 3.997169 | < 1/R**2 > | 31.963491 |
Total Energy= -8.28476520 a.u.
Kinetic Energy= 8.28694424 a.u.
Potential Energy= -16.57170944 a.u.
Virial Ratio = -1.99973705