Description of exchange and correlation in the strongly inhomogeneous electron gas using a nonlocal density functional
Philip P. Rushton, David J. Tozer, Stewart J. Clark
We present exchange-correlation energy densities ${e}_{\mathrm{xc}},$ total energies ${E}_{\mathrm{xc}},$ and holes, calculated for strongly inhomogeneous electron gases using the nonlocal weighted density approximation. The results closely resemble variational Monte Carlo simulations performed recently [Phys. Rev. Lett. 87, 036401 (2001)], demonstrating the effectiveness of a nonlocal density functional description.
Physical review. B, Condensed matter•May 2, 2002•22 citations