"Identifying duplicate crystal structures: XtalComp, an open-source solution."

David C. Lonie, Eva Zurek (2012)

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DOI: 10.1016/J.CPC.2011.11.007

access: closed

type: Journal Article

metadata version: 2020-02-21

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David C. Lonie, Eva Zurek:
Identifying duplicate crystal structures: XtalComp, an open-source solution. Comput. Phys. Commun. 183(3): 690-697 (2012)

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