(1s 2 2s 2 2p 2 5d 1 ) 2 F F 2+
F( r ) = Σ j C j S nl ( α j ,r) Y l,m ( r )
Table 2352.
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 | .740068 | 1.77346147 |
| 2 | 4d | .670805 | -4.00437170 |
| 3 | 5d | .580624 | 3.00824375 |
| 4 | 3d | 3.503494 | .01138867 |
| 5 | 4d | .372867 | -.18041894 |
| 6 | 5d | 2.822093 | .00875058 |
| 7 | 5d | .365165 | .05831641 |
| 8 | 5d | 9.588859 | -.00013178 |
| ORB.ENERGY,a.u. | -.182410 | ||
| NORM | 1.000005 | < R > | 11.316022 | < R2 > | 145.508174 | < 1/R > | .123685 | < 1/R**2 > | .032068 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 2.763410 | .83255358 |
| 2 | 2p | 4.742535 | .19961763 |
| 3 | 2p | 10.355544 | .00822879 |
| 4 | 3p | 1.458485 | .01908190 |
| 5 | 4p | 3.300158 | -.01873605 |
| 6 | 5p | 21.306472 | -.00023184 |
| 7 | 5p | 1.837124 | -.01119213 |
| ORB.ENERGY,a.u. | -3.041200 | ||
| NORM | 1.000000 | < R > | .817334 | < R2 > | .821998 | < 1/R > | 1.577938 | < 1/R**2 > | 3.454251 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 7.430696 | .33383887 |
| 2 | 2s | 3.416262 | -.85138867 |
| 3 | 3s | 3.092413 | -.25944904 |
| 4 | 4s | 10.416563 | .01327195 |
| 5 | 3s | 11.400265 | .01133535 |
| 6 | 5s | 3.186626 | -.01117604 |
| 7 | 5s | 32.286453 | -.00006639 |
| 8 | 3s | 24.820112 | -.00024034 |
| ORB.ENERGY,a.u. | -2.543200 | ||
| NORM | 1.000000 | < R > | .880616 | < R2 > | .916657 | < 1/R > | 1.636889 | < 1/R**2 > | 10.909480 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 8.278218 | .68788850 |
| 2 | 1s | 12.188368 | .22285585 |
| 3 | 1s | 2.689336 | .00561321 |
| 4 | 2s | 9.053283 | .12782362 |
| 5 | 3s | 10.122364 | -.02745872 |
| 6 | 4s | 17.034877 | .00330817 |
| 7 | 5s | 4.812110 | -.00126048 |
| 8 | 5s | 52.805276 | -.00003420 |
| ORB.ENERGY,a.u. | -27.478000 |
| NORM | 1.000000 | < R > | .175225 | < R2 > | .041296 | < 1/R > | 8.645465 | < 1/R**2 > | 151.229970 |
Total Energy= -95.50510103 a.u.
Kinetic Energy= 95.50201877 a.u.
Potential Energy= -191.00711981 a.u.
Virial Ratio = -2.00003227