(1s 2 2s 2 2p 2 3s 1 ) 4 P Na 4+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4130.
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 | 3s- electron | |
| 1 | 1s | 9.180079 | .14813142 |
| 2 | 2s | 3.261072 | -.67877041 |
| 3 | 3s | 2.065293 | 1.27836158 |
| 4 | 4s | 7.853905 | -.03870707 |
| 5 | 5s | 13.268728 | -.00367721 |
| 6 | 4s | 39.849984 | -.00003896 |
| 7 | 5s | 2.103735 | -.00210144 |
| ORB.ENERGY,a.u. | -2.012500 | ||
| NORM | 1.000000 | < R > | 1.891604 | < R2 > | 4.063350 | < 1/R > | .745359 | < 1/R**2 > | 3.362815 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 3.752312 | 1.24556111 |
| 2 | 3p | 4.409621 | -.28329069 |
| 3 | 2p | 9.954944 | .03055278 |
| 4 | 4p | 10.792225 | .00812980 |
| 5 | 5p | 23.235369 | -.00032190 |
| 6 | 5p | 3.025996 | .00303317 |
| ORB.ENERGY,a.u. | -5.710100 | ||
| NORM | 1.000000 | < R > | .615948 | < R2 > | .464668 | < 1/R > | 2.079924 | < 1/R**2 > | 5.947679 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 8.866916 | .36977273 |
| 2 | 2s | 4.484319 | -.84749105 |
| 3 | 3s | 4.182242 | -.28210423 |
| 4 | 4s | 18.396411 | .00260066 |
| 5 | 3s | 10.184148 | .02509814 |
| 6 | 5s | 4.072677 | -.01433421 |
| 7 | 4s | 2.333023 | -.01324303 |
| ORB.ENERGY,a.u. | -5.457800 | ||
| NORM | 1.000000 | < R > | .685670 | < R2 > | .555907 | < 1/R > | 2.121210 | < 1/R**2 > | 18.348956 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.105170 | .88670911 |
| 2 | 1s | 15.035339 | .11573962 |
| 3 | 2s | 7.589101 | .01940737 |
| 4 | 3s | 10.837224 | -.01579910 |
| 5 | 5s | 26.570438 | .00134223 |
| 6 | 4s | 9.078400 | -.00263343 |
| 7 | 5s | 2.953353 | .00057795 |
| 8 | 3s | 46.831114 | -.00007484 |
| ORB.ENERGY,a.u. | -43.976000 |
| NORM | 1.000000 | < R > | .142175 | < R2 > | .027151 | < 1/R > | 10.638021 | < 1/R**2 > | 228.529601 |
Total Energy= -150.76103041 a.u.
Kinetic Energy= 150.78076718 a.u.
Potential Energy= -301.54179758 a.u.
Virial Ratio = -1.99986910