(1s 2 2s 1 5p 1 ) 1 P Be 0
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1151.
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 | 5p- electron | |
| 1 | 2p | .192916 | 3.02642625 |
| 2 | 3p | .247686 | -5.89145712 |
| 3 | 4p | .203898 | 8.14546064 |
| 4 | 5p | .200080 | -6.14215358 |
| 5 | 2p | 1.767759 | .04769984 |
| 6 | 5p | 1.594222 | .00902254 |
| 7 | 3p | 3.382287 | -.00472242 |
| ORB.ENERGY,a.u. | -.020355 | ||
| NORM | 1.000026 | < R > | 35.566047 | < R2 > | 1434.939404 | < 1/R > | .045975 | < 1/R**2 > | .010653 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 3.656315 | .22720968 |
| 2 | 2s | 1.119920 | -.73921716 |
| 3 | 3s | 1.692526 | -.28232208 |
| 4 | 4s | 4.481148 | .02474957 |
| 5 | 3s | 5.194707 | .01551925 |
| 6 | 5s | 1.653026 | -.02890803 |
| 7 | 5s | 16.496182 | -.00015100 |
| 8 | 3s | 44.741253 | .00000778 |
| ORB.ENERGY,a.u. | -.605170 | ||
| NORM | 1.000000 | < R > | 2.288710 | < R2 > | 6.140177 | < 1/R > | .605379 | < 1/R**2 > | 1.440786 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 3.375129 | .89190353 |
| 2 | 1s | 5.923988 | .12525393 |
| 3 | 2s | 1.245907 | .00150385 |
| 4 | 3s | 4.280810 | -.01475851 |
| 5 | 4s | 6.031487 | .00523066 |
| 6 | 5s | 9.580746 | .00192644 |
| 7 | 5s | 29.574191 | -.00005681 |
| ORB.ENERGY,a.u. | -4.532600 |
| NORM | 1.000000 | < R > | .415049 | < R2 > | .233119 | < 1/R > | 3.682190 | < 1/R**2 > | 27.760161 |
Total Energy= -14.30090630 a.u.
Kinetic Energy= 14.29774687 a.u.
Potential Energy= -28.59865317 a.u.
Virial Ratio = -2.00022097