Accurate and efficient structure factors in ultrasoft pseudopotential and projector augmented wave DFT (2023)

First Author: Shi B
Attributed to:  Enabling breakthrough energy materials with advanced microscopy and modelling funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1103/physrevb.108.115112

Publication URI: http://dx.doi.org/10.1103/physrevb.108.115112

Type: Journal Article/Review

Parent Publication: Physical Review B

Issue: 11