(1s 2 2s 2 2p 2 5d 1 ) 4 F Cl 10+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 4352.
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 | 5d- electron | |
| 1 | 3d | 2.857689 | 1.54417718 |
| 2 | 4d | 2.420196 | -4.10955284 |
| 3 | 5d | 2.206191 | 3.29466137 |
| 4 | 3d | 7.984683 | .02733189 |
| 5 | 5d | 4.680056 | -.05881798 |
| 6 | 4d | 20.472605 | -.00026494 |
| 7 | 5d | 1.623393 | -.00638818 |
| ORB.ENERGY,a.u. | -2.495700 | ||
| NORM | 1.000001 | < R > | 3.033882 | < R2 > | 10.447717 | < 1/R > | .459490 | < 1/R**2 > | .441146 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.796149 | 1.12607966 |
| 2 | 3p | 7.970968 | -.14872099 |
| 3 | 2p | 15.948059 | .02114684 |
| 4 | 4p | 17.579169 | .00470262 |
| 5 | 5p | 37.556162 | -.00024852 |
| 6 | 5p | 6.698519 | -.00171505 |
| 7 | 4p | 1.364969 | .00007573 |
| ORB.ENERGY,a.u. | -21.310000 | ||
| NORM | 1.000000 | < R > | .351595 | < R2 > | .149887 | < 1/R > | 3.602281 | < 1/R**2 > | 17.598828 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.334207 | .43065182 |
| 2 | 2s | 7.485979 | -.86849008 |
| 3 | 3s | 7.634501 | -.28603827 |
| 4 | 4s | 28.693603 | .00198639 |
| 5 | 3s | 15.737471 | .01677658 |
| 6 | 5s | 7.753633 | -.01974937 |
| 7 | 5s | 5.844169 | -.00048142 |
| ORB.ENERGY,a.u. | -20.297000 | ||
| NORM | 1.000000 | < R > | .404040 | < R2 > | .191233 | < 1/R > | 3.634311 | < 1/R**2 > | 53.564776 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.060950 | .92144524 |
| 2 | 1s | 24.150845 | .07730165 |
| 3 | 2s | 15.031682 | .01928407 |
| 4 | 3s | 18.604821 | -.01560932 |
| 5 | 5s | 40.482961 | .00084970 |
| 6 | 4s | 97.230543 | -.00003098 |
| 7 | 5s | 12.596961 | .00032755 |
| ORB.ENERGY,a.u. | -117.740000 |
| NORM | 1.000000 | < R > | .090728 | < R2 > | .011030 | < 1/R > | 16.625489 | < 1/R**2 > | 556.391263 |
Total Energy= -383.64280794 a.u.
Kinetic Energy= 383.65817279 a.u.
Potential Energy= -767.30098073 a.u.
Virial Ratio = -1.99995995