(1s 2 2s 2 2p 2 5d 1 ) 2 F N 0
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 | .249139 | 1.68134142 |
| 2 | 4d | .205379 | -5.23729798 |
| 3 | 5d | .197624 | 4.39752826 |
| 4 | 3d | 2.085120 | .00169777 |
| 5 | 4d | .152211 | -.10089920 |
| 6 | 5d | 1.315058 | .00166671 |
| 7 | 4d | 7.080734 | .00002465 |
| ORB.ENERGY,a.u. | -.020072 | ||
| NORM | 1.000028 | < R > | 34.360554 | < R2 > | 1339.431795 | < 1/R > | .040273 | < 1/R**2 > | .003281 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 1.745938 | .72616594 |
| 2 | 2p | 2.996995 | .28492391 |
| 3 | 2p | 6.880990 | .01580779 |
| 4 | 3p | 1.106154 | .02231717 |
| 5 | 2p | 5.992519 | .00419464 |
| 6 | 5p | 8.246470 | .00425559 |
| 7 | 5p | 12.908553 | .00010124 |
| 8 | 5p | 1.195165 | -.00609674 |
| ORB.ENERGY,a.u. | -1.008700 | ||
| NORM | 1.000000 | < R > | 1.243587 | < R2 > | 1.932023 | < 1/R > | 1.055983 | < 1/R**2 > | 1.580532 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 5.897574 | .28626190 |
| 2 | 2s | 2.455023 | -.83259139 |
| 3 | 3s | 1.982319 | -.26756578 |
| 4 | 4s | 8.338656 | .02236040 |
| 5 | 3s | 10.219509 | .00699693 |
| 6 | 5s | 2.836735 | -.01420309 |
| 7 | 5s | 16.443890 | .00093054 |
| 8 | 3s | .968063 | -.00043054 |
| ORB.ENERGY,a.u. | -.654320 | ||
| NORM | 1.000000 | < R > | 1.252843 | < R2 > | 1.874255 | < 1/R > | 1.140834 | < 1/R**2 > | 5.286867 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 6.230001 | .71793018 |
| 2 | 1s | 9.301787 | .22517701 |
| 3 | 1s | 2.651583 | .00483182 |
| 4 | 2s | 6.903679 | .08341940 |
| 5 | 3s | 7.776696 | -.02158508 |
| 6 | 4s | 12.680715 | .00689020 |
| 7 | 5s | 28.044921 | .00017126 |
| ORB.ENERGY,a.u. | -15.024000 |
| NORM | 1.000000 | < R > | .228085 | < R2 > | .070094 | < 1/R > | 6.656723 | < 1/R**2 > | 89.910882 |
Total Energy= -53.90837323 a.u.
Kinetic Energy= 53.90807351 a.u.
Potential Energy= -107.81644674 a.u.
Virial Ratio = -2.00000556