(1s 2 2s 2 2p 4 5p 1 ) 2 P Na 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 | 2.249115 | .11549459 |
| 2 | 3p | 1.010822 | -1.19987227 |
| 3 | 4p | .760754 | 3.09986641 |
| 4 | 5p | .658860 | -2.65602859 |
| 5 | 5p | 14.177043 | -.00096742 |
| 6 | 4p | 21.353442 | -.00032399 |
| 7 | 2p | 5.867701 | .02672922 |
| 8 | 2p | 2.254975 | -.00106883 |
| ORB.ENERGY,a.u. | -.216700 | ||
| NORM | 1.000009 | < R > | 10.102658 | < R2 > | 114.656565 | < 1/R > | .134619 | < 1/R**2 > | .052983 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.155333 | 1.12252573 |
| 2 | 3p | 3.759586 | -.26176878 |
| 3 | 2p | 6.164200 | .19749260 |
| 4 | 4p | 8.197963 | -.02196017 |
| 5 | 5p | .902369 | .05370613 |
| 6 | 4p | .681752 | -.04901148 |
| 7 | 3p | 10.418586 | -.01908620 |
| 8 | 5p | 26.151030 | -.00016337 |
| 9 | 3p | .421237 | -.00589092 |
| ORB.ENERGY,a.u. | -3.404200 | ||
| NORM | 1.000000 | < R > | .689087 | < R2 > | .600109 | < 1/R > | 1.897542 | < 1/R**2 > | 5.059498 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.054485 | .33596740 |
| 2 | 2s | 4.241690 | -.83214451 |
| 3 | 3s | 3.564479 | -.29618173 |
| 4 | 4s | 19.302148 | .00675076 |
| 5 | 3s | 22.752108 | .00105321 |
| 6 | 5s | 15.614003 | .00945417 |
| 7 | 5s | 9.513565 | .00232288 |
| 8 | 4s | 2.053433 | -.00028663 |
| ORB.ENERGY,a.u. | -3.726900 | ||
| NORM | 1.000000 | < R > | .727696 | < R2 > | .629196 | < 1/R > | 1.991961 | < 1/R**2 > | 16.291786 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.243441 | .91124373 |
| 2 | 1s | 15.433650 | .08736714 |
| 3 | 2s | 5.654104 | .01837704 |
| 4 | 3s | 7.090340 | -.01931303 |
| 5 | 4s | 9.039757 | .00952622 |
| 6 | 5s | 26.198134 | .00114155 |
| 7 | 4s | 61.529010 | -.00004754 |
| ORB.ENERGY,a.u. | -41.160000 |
| NORM | 1.000000 | < R > | .142640 | < R2 > | .027372 | < 1/R > | 10.616923 | < 1/R**2 > | 227.841532 |
Total Energy= -157.64496541 a.u.
Kinetic Energy= 157.64043425 a.u.
Potential Energy= -315.28539967 a.u.
Virial Ratio = -2.00002874