(1s 1 4p 1 ) 1 P Be 2+
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 | .743826 | 2.37217046 |
| 2 | 3p | .759023 | -6.04493377 |
| 3 | 4p | .749182 | 4.52372481 |
| 4 | 5p | .930376 | -.17538832 |
| 5 | 3p | 4.832442 | -.00699673 |
| 6 | 4p | 3.277422 | -.01029305 |
| ORB.ENERGY,a.u. | -.280760 | ||
| NORM | 1.000000 | < R > | 7.728113 | < R2 > | 67.736059 | < 1/R > | .185897 | < 1/R**2 > | .091658 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.918541 | .75850853 |
| 2 | 1s | 4.102183 | .25487813 |
| 3 | 2s | 3.920878 | -.01493441 |
| 4 | 3s | 4.121670 | -.00063747 |
| 5 | 4s | 1.755375 | .00016277 |
| ORB.ENERGY,a.u. | -7.780800 |
| NORM | 1.000000 | < R > | .374929 | < R2 > | .187430 | < 1/R > | 4.000642 | < 1/R**2 > | 32.008742 |
Total Energy= -8.28437428 a.u.
Kinetic Energy= 8.27904473 a.u.
Potential Energy= -16.56341900 a.u.
Virial Ratio = -2.00064374