Phaseless auxiliary field quantum Monte Carlo with projector-augmented wave method for solids.

Autor: Taheridehkordi, Amir1 (AUTHOR) amir.taheridehkordi@univie.ac.at, Schlipf, Martin2 (AUTHOR), Sukurma, Zoran3 (AUTHOR), Humer, Moritz3 (AUTHOR), Grüneis, Andreas4 (AUTHOR), Kresse, Georg1,2 (AUTHOR)
Zdroj: Journal of Chemical Physics. 7/28/2023, Vol. 159 Issue 4, p1-14. 14p.
Databáze: Academic Search Ultimate