(1s 2 2s 2 5p 1 ) 2 P N 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2151.
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 | 1.540825 | .26045620 |
| 2 | 3p | .840408 | -2.00720388 |
| 3 | 4p | .666782 | 5.47559349 |
| 4 | 5p | .637038 | -4.38371587 |
| 5 | 2p | 3.545617 | .05965454 |
| 6 | 5p | 3.947962 | .00460198 |
| 7 | 3p | 6.641045 | -.00425686 |
| ORB.ENERGY,a.u. | -.200390 | ||
| NORM | .999988 | < R > | 10.920885 | < R2 > | 134.179156 | < 1/R > | .133300 | < 1/R**2 > | .067674 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 6.221683 | .29894950 |
| 2 | 2s | 2.337213 | -.74843101 |
| 3 | 3s | 3.506674 | -.28693446 |
| 4 | 4s | 9.834192 | .01390105 |
| 5 | 5s | 3.093243 | -.05064091 |
| 6 | 3s | 9.263980 | .00567025 |
| 7 | 5s | 12.829237 | -.00227541 |
| 8 | 5s | 2.834819 | .01654538 |
| ORB.ENERGY,a.u. | -2.618400 | ||
| NORM | 1.000000 | < R > | 1.113432 | < R2 > | 1.454919 | < 1/R > | 1.284945 | < 1/R**2 > | 6.638873 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.249500 | .70845210 |
| 2 | 1s | 9.280872 | .23152983 |
| 3 | 2s | 7.147440 | .08405212 |
| 4 | 3s | 7.849251 | -.01471320 |
| 5 | 4s | 13.046168 | .00825395 |
| 6 | 5s | 16.931889 | -.00114706 |
| ORB.ENERGY,a.u. | -17.798000 |
| NORM | 1.000000 | < R > | .227028 | < R2 > | .069282 | < 1/R > | 6.675357 | < 1/R**2 > | 90.290862 |
Total Energy= -51.28269075 a.u.
Kinetic Energy= 51.28270091 a.u.
Potential Energy= -102.56539166 a.u.
Virial Ratio = -1.99999980