34 citations · 34 across the 2 of their papers we have counts for
2 papers
cond-mat.mtrl-sci2015★ 34 cited
Better Band Gaps with Asymptotically Corrected Local Exchange Potentials
Prashant Singh, Manoj K. Harbola, M. Hemanadhan +2
We formulate a spin-polarized van Leeuwen and Baerends (vLB) correction to the local density approximation (LDA) exchange potential [Phys. Rev. A 49, 2421 (1994)] that enforces the…
physics.chem-ph2014
Estimation of correlation energy for excited-states of atoms
M. Hemanadhan, Manoj K. Harbola
The correlation energies of various atoms in their excited-states are estimated by modelling the Coulomb hole following the previous work by Chakravorty and Clementi. The parameter…