(1s 2 2s 2 2p 1 4p 1 ) 1 P Na 5+
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 | 5.014949 | .23547964 |
| 2 | 3p | 1.325184 | -.43377920 |
| 3 | 5p | 1.801610 | 1.07938757 |
| 4 | 4p | 2.663900 | -.71629310 |
| 5 | 5p | 6.676320 | .02492703 |
| 6 | 4p | 16.222619 | -.00254043 |
| 7 | 5p | 1.590538 | .52276600 |
| 8 | 5p | 38.673516 | -.00019300 |
| 9 | 4p | 60.883561 | -.00003540 |
| ORB.ENERGY,a.u. | -1.281700 | ||
| NORM | 1.000000 | < R > | 3.372027 | < R2 > | 12.852564 | < 1/R > | .417614 | < 1/R**2 > | .491407 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2p- electron | |
| 1 | 2p | 4.143123 | 1.08013859 |
| 2 | 3p | 5.043384 | -.11148064 |
| 3 | 2p | 9.618684 | .03067627 |
| 4 | 5p | 11.845782 | .00623086 |
| 5 | 4p | 23.456502 | -.00054871 |
| 6 | 5p | 4.023473 | .00494899 |
| 7 | 5p | 73.592718 | -.00001106 |
| ORB.ENERGY,a.u. | -7.289300 | ||
| NORM | 1.000000 | < R > | .583564 | < R2 > | .413978 | < 1/R > | 2.177748 | < 1/R**2 > | 6.463492 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 2s- electron | |
| 1 | 1s | 9.715529 | .33564017 |
| 2 | 2s | 3.815697 | -.79329892 |
| 3 | 3s | 5.825269 | -.27564183 |
| 4 | 4s | 20.647202 | .00177263 |
| 5 | 5s | 11.421766 | -.01485213 |
| 6 | 5s | 4.297090 | .01970789 |
| 7 | 4s | 1.779328 | .00036868 |
| ORB.ENERGY,a.u. | -7.150900 | ||
| NORM | 1.000000 | < R > | .658196 | < R2 > | .508108 | < 1/R > | 2.208673 | < 1/R**2 > | 19.767551 |
| j | S nl j (α j ,r) | C j | |
| nl j | α j | 1s- electron | |
| 1 | 1s | 10.213137 | .92173152 |
| 2 | 1s | 16.004894 | .08103718 |
| 3 | 2s | 8.747562 | .01668862 |
| 4 | 3s | 11.360331 | -.01627015 |
| 5 | 4s | 54.232965 | -.00008563 |
| 6 | 5s | 25.189024 | .00102002 |
| ORB.ENERGY,a.u. | -46.135000 |
| NORM | 1.000000 | < R > | .141876 | < R2 > | .027010 | < 1/R > | 10.652202 | < 1/R**2 > | 229.001855 |
Total Energy= -143.70647351 a.u.
Kinetic Energy= 143.72760665 a.u.
Potential Energy= -287.43408016 a.u.
Virial Ratio = -1.99985296