(1s 2 2s 2 2p 3 4p 1 ) 3 P Cl 9+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 3141.
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 | 8.566187 | .19204727 |
| 2 | 3p | 2.115491 | 2.47507135 |
| 3 | 4p | 3.798411 | -1.90698446 |
| 4 | 5p | 6.659486 | -.16902168 |
| 5 | 3p | 22.985228 | -.00100241 |
| 6 | 4p | 1.338554 | .03632020 |
| 7 | 5p | 2.070823 | -.22418392 |
| 8 | 5p | 47.248281 | .00012168 |
| 9 | 4p | 71.849855 | .00003144 |
| 10 | 3p | .959507 | -.01235829 |
| ORB.ENERGY,a.u. | -3.455800 | ||
| NORM | 1.000000 | < R > | 2.083145 | < R2 > | 4.904985 | < 1/R > | .667957 | < 1/R**2 > | 1.208089 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 6.788328 | 1.26363026 |
| 2 | 3p | 8.802271 | -.31953487 |
| 3 | 4p | 11.001819 | .05464813 |
| 4 | 5p | 2.785566 | .02626980 |
| 5 | 4p | 27.678777 | -.00151900 |
| 6 | 4p | 2.490276 | -.01825005 |
| 7 | 3p | 32.464597 | -.00034846 |
| ORB.ENERGY,a.u. | -18.802000 | ||
| NORM | 1.000000 | < R > | .360837 | < R2 > | .158598 | < 1/R > | 3.522304 | < 1/R**2 > | 16.890129 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 13.361522 | .41990010 |
| 2 | 2s | 7.403356 | -.86652330 |
| 3 | 3s | 7.188941 | -.29012569 |
| 4 | 4s | 29.153394 | .00190201 |
| 5 | 3s | 15.296436 | .01745341 |
| 6 | 5s | 7.332434 | -.01522070 |
| 7 | 4s | 2.325249 | .00014893 |
| ORB.ENERGY,a.u. | -18.579000 | ||
| NORM | 1.000000 | < R > | .412605 | < R2 > | .199823 | < 1/R > | 3.554288 | < 1/R**2 > | 51.415884 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 16.179821 | .94117501 |
| 2 | 1s | 25.225510 | .05648258 |
| 3 | 2s | 14.481258 | .01865484 |
| 4 | 3s | 20.375653 | -.01477395 |
| 5 | 4s | 30.935454 | .00269938 |
| 6 | 5s | 59.532887 | .00009403 |
| 7 | 5s | 12.221355 | .00044934 |
| ORB.ENERGY,a.u. | -114.870000 |
| NORM | 1.000000 | < R > | .090901 | < R2 > | .011081 | < 1/R > | 16.605133 | < 1/R**2 > | 555.331093 |
Total Energy= -404.15657911 a.u.
Kinetic Energy= 404.12155238 a.u.
Potential Energy= -808.27813149 a.u.
Virial Ratio = -2.00008667