(1s 2 2s 2 2p 4 5p 1 ) 2 P Ar 9+
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 | 4.465899 | .33146906 |
2 | 3p | 2.513951 | -2.95360333 |
3 | 4p | 2.276886 | 5.98344960 |
4 | 5p | 2.075575 | -3.94264572 |
5 | 2p | 10.715263 | .04586606 |
6 | 5p | 11.937480 | .00276551 |
7 | 4p | 34.368576 | -.00023509 |
ORB.ENERGY,a.u. | -2.176200 |
NORM | 1.000002 | < R > | 3.355858 | < R2 > | 12.668099 | < 1/R > | .424154 | < 1/R**2 > | .609314 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2p- electron | |
1 | 2p | 6.487977 | 1.02293763 |
2 | 3p | 6.997160 | -.13705781 |
3 | 2p | 11.802210 | .13027616 |
4 | 4p | 34.438069 | -.00033982 |
5 | 5p | 2.698951 | .04469737 |
6 | 4p | 2.088899 | -.03954984 |
7 | 3p | 18.045236 | -.00587475 |
8 | 3p | 1.399739 | -.00571502 |
ORB.ENERGY,a.u. | -19.292000 |
NORM | 1.000000 | < R > | .347669 | < R2 > | .147967 | < 1/R > | 3.672263 | < 1/R**2 > | 18.447577 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 2s- electron | |
1 | 1s | 14.158281 | .41619010 |
2 | 2s | 7.816502 | -.86319709 |
3 | 3s | 7.318156 | -.30241254 |
4 | 4s | 13.666633 | .00370767 |
5 | 3s | 17.445635 | .01428376 |
6 | 5s | 38.706469 | .00070269 |
7 | 5s | 6.956531 | -.00501797 |
8 | 4s | 4.517052 | .00040934 |
9 | 3s | 72.102727 | -.00002747 |
ORB.ENERGY,a.u. | -20.023000 |
NORM | 1.000000 | < R > | .393121 | < R2 > | .181629 | < 1/R > | 3.731213 | < 1/R**2 > | 56.797303 |
j | S nl j (α j ,r) | C j | |
nl j | α j | 1s- electron | |
1 | 1s | 17.131977 | .92015440 |
2 | 1s | 24.628486 | .07623517 |
3 | 2s | 11.262196 | .02014716 |
4 | 3s | 13.628155 | -.02040879 |
5 | 4s | 16.323433 | .00894536 |
6 | 5s | 44.121519 | .00069254 |
7 | 4s | 102.256157 | -.00002581 |
ORB.ENERGY,a.u. | -127.520000 |
NORM | 1.000000 | < R > | .085844 | < R2 > | .009886 | < 1/R > | 17.586951 | < 1/R**2 > | 622.979469 |
Total Energy= -475.11931773 a.u.
Kinetic Energy= 475.08987084 a.u.
Potential Energy= -950.20918857 a.u.
Virial Ratio = -2.00006198