Self-interaction free local exchange potentials applied to metallic systems
(2017)
Journal Article
Clark, S. J., Hollins, T. W., Refson, K., & Gidopoulos, N. I. (2017). Self-interaction free local exchange potentials applied to metallic systems. Journal of Physics: Condensed Matter, 29(37), Article 374002. https://doi.org/10.1088/1361-648x/aa7ba6
We extend the formalism of local exchange methods to calculate and investigate the electronic structure of metals. It is well-known that the Hartree-Fock method when applied to metals shows unphysical behaviour, however the accurate treatment of exch... Read More about Self-interaction free local exchange potentials applied to metallic systems.