(1s 2 2s 2 2p 4 3p 1 ) 4 P Na 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4131.
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 | 3p- electron | |
| 1 | 2p | 3.479579 | .24855733 |
| 2 | 3p | 1.248574 | -.84177777 |
| 3 | 4p | 1.936329 | -.21886917 |
| 4 | 2p | 6.780473 | .05305854 |
| 5 | 5p | 25.271821 | -.00042375 |
| 6 | 5p | 9.480340 | .00635141 |
| 7 | 5p | 1.290889 | .03191628 |
| 8 | 4p | 38.197614 | -.00007873 |
| ORB.ENERGY,a.u. | -.768030 | ||
| NORM | 1.000000 | < R > | 2.683664 | < R2 > | 8.262033 | < 1/R > | .494457 | < 1/R**2 > | .545898 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.187787 | 1.26252700 |
| 2 | 2p | 8.097613 | .08251539 |
| 3 | 3p | 3.791690 | -.35800640 |
| 4 | 4p | 9.154241 | .02193687 |
| 5 | 5p | 27.960349 | -.00013008 |
| 6 | 5p | 1.766581 | .00378429 |
| 7 | 4p | 2.671954 | .01183859 |
| ORB.ENERGY,a.u. | -3.112000 | ||
| NORM | 1.000000 | < R > | .693437 | < R2 > | .601023 | < 1/R > | 1.889128 | < 1/R**2 > | 5.024234 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.075940 | .33410282 |
| 2 | 2s | 4.229341 | -.82904606 |
| 3 | 3s | 3.555385 | -.29480858 |
| 4 | 4s | 13.786946 | .01116815 |
| 5 | 3s | 15.649724 | .00448902 |
| 6 | 5s | 27.172523 | .00046372 |
| 7 | 5s | 2.672618 | -.00238189 |
| ORB.ENERGY,a.u. | -3.726900 | ||
| NORM | 1.000000 | < R > | .729444 | < R2 > | .632746 | < 1/R > | 1.987796 | < 1/R**2 > | 16.230368 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.242892 | .91124962 |
| 2 | 1s | 15.434263 | .08736481 |
| 3 | 2s | 5.649861 | .01842928 |
| 4 | 3s | 7.070824 | -.01936872 |
| 5 | 4s | 9.009882 | .00959005 |
| 6 | 5s | 26.034295 | .00111098 |
| 7 | 4s | 61.067407 | -.00005521 |
| ORB.ENERGY,a.u. | -41.160000 |
| NORM | 1.000000 | < R > | .142653 | < R2 > | .027379 | < 1/R > | 10.616258 | < 1/R**2 > | 227.819340 |
Total Energy= -158.16127228 a.u.
Kinetic Energy= 158.19167611 a.u.
Potential Energy= -316.35294839 a.u.
Virial Ratio = -1.99980780