On the temperature dependence of H-U (iso) in the riding hydrogen model

The temperature dependence of H-U (iso) in N-acetyl-l-4-hydroxyproline monohydrate is investigated. Imposing a constant temperature-independent multiplier of 1.2 or 1.5 for the riding hydrogen model is found to be inaccurate, and severely underestimates H-U (iso) below 100 K. Neutron diffraction dat...

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Detalles Bibliográficos
Autores principales: Lübben, Jens, Volkmann, Christian, Grabowsky, Simon, Edwards, Alison, Morgenroth, Wolfgang, Fabbiani, Francesca P. A., Sheldrick, George M., Dittrich, Birger
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Research Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4075069/
https://www.ncbi.nlm.nih.gov/pubmed/25970187
http://dx.doi.org/10.1107/S2053273314010626

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4075069/
https://www.ncbi.nlm.nih.gov/pubmed/25970187
http://dx.doi.org/10.1107/S2053273314010626

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