International Journal Open Access

First principles methods using CASTEP

Authors

Stewart J. Clark, Matthew Segall, Chris J. Pickard, Philip J. Hasnip, Matt I. J. Probert, Keith Refson, Mike C. Payne

Journal

Zeitschrift für Kristallographie - Crystalline Materials

Year Published

2005

Publisher

De Gruyter

Citations

14623 citations

Type

Article

Language

EN

Topics & Concepts

CASTEP (1.00) Code (set theory) (0.49) Computer science (0.49)

Abstract

First principles methods using CASTEP - Full text available via OpenAlex

Author Details

Stewart J. Clark

ORCID

Matthew Segall

ORCID

Chris J. Pickard

ORCID

Philip J. Hasnip

ORCID

Matt I. J. Probert

ORCID

Keith Refson

ORCID

Mike C. Payne

ORCID

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