Quasi-static deformation simulations of molecular crystals

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Quasi-static deformation simulations of molecular crystals

Identification of the mechanical performance of pharmaceuticals in the drug discovery process can determine the tabletability of a target molecule. Determination of the active slip systems and their ranking in molecular crystals is challenging because molecules offer a set of configurational variabl...

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Bibliographic Details
Main Authors:	Hamad, Mustafa S., Boissier, C., Calo, Victor, Gale, Julian, Nilsson Lill, S.O., Parkinson, Gordon M., Rohl, Andrew
Format:	Journal Article
Language:	English
Published:	ROYAL SOC CHEMISTRY 2023
Subjects:	Science & Technology Physical Sciences Chemistry, Multidisciplinary Crystallography Chemistry METASTABLE ANTHRACENE PLASTIC-DEFORMATION ATTACHMENT ENERGY SLIP SYSTEMS BASAL SLIP VISUALIZATION PHASE SHEAR IDENTIFICATION TRANSITION
Online Access:	http://purl.org/au-research/grants/arc/FL180100087 http://hdl.handle.net/20.500.11937/90751

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