(1s 2 2s 1 4p 1 ) 1 P Al 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 1141.
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 | 4p- electron | |
| 1 | 2p | 5.186307 | .47678660 |
| 2 | 3p | 3.007522 | -.94070801 |
| 3 | 5p | 2.682752 | 1.51338321 |
| 4 | 4p | 3.941950 | -.40342600 |
| 5 | 5p | 6.192719 | .08120650 |
| 6 | 4p | 12.489023 | -.01514255 |
| 7 | 5p | 29.110213 | -.00204618 |
| 8 | 4p | 49.201308 | -.00058188 |
| 9 | 3p | 1.442363 | .00616204 |
| 10 | 5p | 71.935701 | .00016368 |
| ORB.ENERGY,a.u. | -3.222900 | ||
| NORM | 1.000000 | < R > | 2.230033 | < R2 > | 5.640527 | < 1/R > | .646363 | < 1/R**2 > | 1.156513 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 10.750979 | .41043634 |
| 2 | 2s | 5.509375 | -.79073047 |
| 3 | 3s | 6.580916 | -.30257244 |
| 4 | 5s | 11.087756 | -.02994613 |
| 5 | 4s | 23.042501 | .00677041 |
| 6 | 5s | 30.687795 | -.00153065 |
| 7 | 5s | 3.004964 | -.00068238 |
| 8 | 3s | 47.802640 | .00006589 |
| ORB.ENERGY,a.u. | -15.644000 | ||
| NORM | 1.000000 | < R > | .512213 | < R2 > | .305973 | < 1/R > | 2.870989 | < 1/R**2 > | 33.245046 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 12.429658 | .94250494 |
| 2 | 1s | 20.350568 | .04709502 |
| 3 | 2s | 15.396834 | .01493693 |
| 4 | 3s | 6.843293 | .00080461 |
| 5 | 4s | 48.168583 | -.00071431 |
| 6 | 5s | 63.082746 | .00027581 |
| 7 | 5s | 15.105805 | .00126943 |
| ORB.ENERGY,a.u. | -71.915000 |
| NORM | 1.000000 | < R > | .119025 | < R2 > | .018975 | < 1/R > | 12.672840 | < 1/R**2 > | 323.449208 |
Total Energy= -180.42092426 a.u.
Kinetic Energy= 180.40726229 a.u.
Potential Energy= -360.82818655 a.u.
Virial Ratio = -2.00007573