(1s 2 2s 2 2p 3 5p 1 ) 5 P Mg 4+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 5151.
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 | 3.309774 | .17172813 |
| 2 | 3p | 1.483799 | -1.67869655 |
| 3 | 4p | 1.240676 | 3.75679876 |
| 4 | 5p | 1.071647 | -2.84536451 |
| 5 | 2p | 6.564768 | .04937650 |
| 6 | 5p | 18.903993 | -.00111484 |
| 7 | 4p | 27.923205 | -.00032069 |
| 8 | 4p | .549476 | .00207428 |
| ORB.ENERGY,a.u. | -.581190 | ||
| NORM | 1.000004 | < R > | 6.279596 | < R2 > | 44.322617 | < 1/R > | .227499 | < 1/R**2 > | .190641 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 4.266224 | 1.43392098 |
| 2 | 3p | 5.555108 | -.55248778 |
| 3 | 4p | 6.966284 | .11271746 |
| 4 | 5p | 22.244799 | -.00250090 |
| 5 | 4p | 2.650612 | .00985415 |
| 6 | 4p | 31.561827 | -.00076018 |
| 7 | 5p | 2.440563 | -.00614970 |
| 8 | 3p | 1.502949 | .00221647 |
| 9 | 5p | 103.538499 | -.00001220 |
| ORB.ENERGY,a.u. | -6.628900 | ||
| NORM | 1.000000 | < R > | .569709 | < R2 > | .398218 | < 1/R > | 2.254864 | < 1/R**2 > | 7.013707 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.752707 | .36503074 |
| 2 | 2s | 4.841471 | -.84006203 |
| 3 | 3s | 4.499997 | -.28100354 |
| 4 | 4s | 19.449271 | .00242970 |
| 5 | 3s | 11.727188 | .01672841 |
| 6 | 5s | 4.645490 | -.01771766 |
| ORB.ENERGY,a.u. | -6.256600 | ||
| NORM | 1.000000 | < R > | .629304 | < R2 > | .467152 | < 1/R > | 2.309504 | < 1/R**2 > | 21.789618 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 11.167253 | .91184142 |
| 2 | 1s | 17.087435 | .08750779 |
| 3 | 2s | 9.772541 | .01782583 |
| 4 | 3s | 13.871213 | -.01495623 |
| 5 | 4s | 22.011739 | .00341761 |
| 6 | 5s | 40.223992 | .00010267 |
| 7 | 5s | 8.204355 | .00072540 |
| ORB.ENERGY,a.u. | -52.023000 |
| NORM | 1.000000 | < R > | .130170 | < R2 > | .022768 | < 1/R > | 11.620786 | < 1/R**2 > | 272.662236 |
Total Energy= -187.43623043 a.u.
Kinetic Energy= 187.44148728 a.u.
Potential Energy= -374.87771771 a.u.
Virial Ratio = -1.99997195