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Up: 19.1 Density Functionals
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19.1.35 THGFL:
D. J. Tozer, N. C. Handy and W. H. Green, Chem. Phys. Lett. 273, 183 (1997)
Density dependent first row exchange-correlation functional for closed shell
systems.
 |
(195) |
where
 |
(196) |
 |
(197) |
![\begin{displaymath}
t
=
[7/6,4/3,3/2,5/3]
\end{displaymath}](img520.gif) |
(198) |
and
![\begin{displaymath}
\omega
=
[- 1.06141, 0.898203,- 1.34439, 0.302369]
.\end{displaymath}](img521.gif) |
(199) |
molpro@molpro.net
Feb 26, 2003