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Exact direct-space asymmetric units for the 230 crystallographic space groups

It is well known that the direct-space asymmetric unit definitions found in the International Tables for Crystallography, Volume A, are inexact at the borders. Face- and edge-specific sub-conditions have to be added to remove parts redundant under symmetry. This paper introduces a concise geometric...

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Detalles Bibliográficos
Autores principales: Grosse-Kunstleve, Ralf W., Wong, Buddy, Mustyakimov, Marat, Adams, Paul D.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3082335/
https://www.ncbi.nlm.nih.gov/pubmed/21487185
http://dx.doi.org/10.1107/S0108767311007008