(1s 1 5p 1 ) 3 P Li +
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3151.
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 | .325819 | 5.07272921 |
| 2 | 3p | .524376 | -5.92295003 |
| 3 | 4p | .358044 | 8.39893279 |
| 4 | 5p | .386440 | -8.95820642 |
| 5 | 2p | 2.875422 | .00834231 |
| 6 | 5p | 1.017543 | .06766529 |
| ORB.ENERGY,a.u. | -.082135 | ||
| NORM | .999985 | < R > | 17.880855 | < R2 > | 360.123190 | < 1/R > | .082415 | < 1/R**2 > | .024241 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 2.928890 | .75886099 |
| 2 | 1s | 3.102270 | .25447870 |
| 3 | 2s | 2.980355 | -.01449397 |
| 4 | 3s | 3.336171 | -.00078266 |
| 5 | 4s | 1.465033 | -.00011702 |
| ORB.ENERGY,a.u. | -4.402100 |
| NORM | 1.000000 | < R > | .500276 | < R2 > | .333758 | < 1/R > | 2.998845 | < 1/R**2 > | 17.988910 |
Total Energy= -4.58094944 a.u.
Kinetic Energy= 4.58159239 a.u.
Potential Energy= -9.16254183 a.u.
Virial Ratio = -1.99985967