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Hirshfeld atom like refinement with alternative electron density partitions

Hirshfeld atom refinement is one of the most successful methods for the accurate determination of structural parameters for hydrogen atoms from X-ray diffraction data. This work introduces a generalization of the method [generalized atom refinement (GAR)], consisting of the application of various me...

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Detalles Bibliográficos
Autores principales:	Chodkiewicz, Michał Leszek, Woińska, Magdalena, Woźniak, Krzysztof
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	International Union of Crystallography 2020
Materias:	Research Papers
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7642787/ https://www.ncbi.nlm.nih.gov/pubmed/33209330 http://dx.doi.org/10.1107/S2052252520013603

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