Evaluating Hellmann–Feynman forces within non-local pseudopotentials-Reference-Cited by-同舟云学术

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Evaluating Hellmann–Feynman forces within non-local pseudopotentials

Published:2020-05 Issue: Volume:250 Page:107034
ISSN:0010-4655
Container-title:Computer Physics Communications
language:en
Short-container-title:Computer Physics Communications

Author:

Novák Matyáš,Vackář Jiří,Cimrman Robert^ORCID

Funder

Czech Science Foundation, Czech Republic

CEDAMNF project, Czech Republic

Ministry of Education, Youth and Sports OP RDE programme, Czech Republic

Publisher

Elsevier BV

Subject

General Physics and Astronomy,Hardware and Architecture

Reference34 articles.

1. Advances in the Theory of Quantum Systems in Chemistry and Physics;Vackář,2012

2. Momentum-space formalism for the total energy of solids

3. Finite element methods;Ciarlet,1991

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