Optimization algorithm for the generation of ONCV pseudopotentials

Published 2015 View Full Article

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Title
Optimization algorithm for the generation of ONCV pseudopotentials
Authors
Keywords
Density functional theory, Pseudopotential, Plane wave, All-electron calculation, Condensed matter
Journal
COMPUTER PHYSICS COMMUNICATIONS
Volume 196, Issue -, Pages 36-44
Publisher
Elsevier BV
Online
2015-05-30
DOI
10.1016/j.cpc.2015.05.011

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