18.1.19 MK00: Exchange Functional for Accurate Virtual Orbital Energies

Next: 18.1.20 MK00B: Exchange Functional Up: 18.1 Density Functionals Previous: 18.1.18 LYP: Lee, Yang

F. R. Manby and P. J. Knowles, J. Chem. Phys. 112, 7002 (2000)

$\begin{displaymath} K=- \sum_s {\frac {3\pi \rho_{s}^{3}}{\tau_{s}- \upsilon_{s}/4}} .\end{displaymath}$

(92)

P.J. Knowles and H.-J. Werner
molpro@tc.bham.ac.uk
Jan 15, 2002