Literature DB >> 26094853

A systematic typology for negative Poisson's ratio materials and the prediction of complete auxeticity in pure silica zeolite JST.

M Siddorn1, F-X Coudert, K E Evans, A Marmier.   

Abstract

Single crystals can commonly have negative Poisson's ratio in a few directions; however more generalised auxeticity is rarer. We propose a typology to distinguish auxetic materials. We characterise numerous single crystals and demonstrate that partial auxeticity occurs for around 37%. We find average auxeticity to be limited to α-cristobalite and no example of complete auxeticity. We simulate two hundreds pure silica zeolites with empirical potentials and quantum chemistry methods, and for the first time identify complete auxeticity in a zeolite network, JST.

Entities:  

Year:  2015        PMID: 26094853     DOI: 10.1039/c5cp01168j

Source DB:  PubMed          Journal:  Phys Chem Chem Phys        ISSN: 1463-9076            Impact factor:   3.676


  3 in total

1.  Computational prediction of new auxetic materials.

Authors:  John Dagdelen; Joseph Montoya; Maarten de Jong; Kristin Persson
Journal:  Nat Commun       Date:  2017-08-22       Impact factor: 14.919

2.  Coincident molecular auxeticity and negative order parameter in a liquid crystal elastomer.

Authors:  D Mistry; S D Connell; S L Mickthwaite; P B Morgan; J H Clamp; H F Gleeson
Journal:  Nat Commun       Date:  2018-12-04       Impact factor: 14.919

3.  Systematic exploration of the mechanical properties of 13 621 inorganic compounds.

Authors:  Siwar Chibani; François-Xavier Coudert
Journal:  Chem Sci       Date:  2019-07-31       Impact factor: 9.825

  3 in total

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