(1s 1 5s 1 ) 1 S O 6+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1050.
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 | 5s- electron | |
| 1 | 1s | .935082 | 1.10055998 |
| 2 | 2s | 1.652254 | -4.18165955 |
| 3 | 3s | 1.688285 | 7.91713703 |
| 4 | 4s | 1.320347 | -16.63228277 |
| 5 | 5s | 1.387478 | 12.63745084 |
| 6 | 2s | 5.435147 | .04015131 |
| 7 | 5s | 16.795125 | .00078420 |
| 8 | 2s | 16.770068 | -.00026697 |
| ORB.ENERGY,a.u. | -1.025700 | ||
| NORM | 1.000020 | < R > | 5.257545 | < R2 > | 30.970430 | < 1/R > | .266820 | < 1/R**2 > | .349659 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | .732798 | .40074707 |
| 2 | 1s | 8.018657 | .98747474 |
| 3 | 2s | 3.137577 | -.14018404 |
| 4 | 3s | 1.135722 | -.45005647 |
| 5 | 4s | 1.039776 | .40186140 |
| 6 | 3s | .607617 | -.38132084 |
| 7 | 5s | 4.058538 | -.02658513 |
| 8 | 5s | .728450 | .17450656 |
| 9 | 4s | 13.488338 | -.00007064 |
| 10 | 3s | .118059 | .00019480 |
| ORB.ENERGY,a.u. | -31.746000 |
| NORM | 1.000000 | < R > | .191220 | < R2 > | .074037 | < 1/R > | 8.015797 | < 1/R**2 > | 128.446643 |
Total Energy= -33.00244746 a.u.
Kinetic Energy= 32.99791019 a.u.
Potential Energy= -66.00035764 a.u.
Virial Ratio = -2.00013750