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

نویسندگان

  • M Siddorn
  • F-X Coudert
  • K E Evans
  • A Marmier
چکیده

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.

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عنوان ژورنال:
  • Physical chemistry chemical physics : PCCP

دوره 17 27  شماره 

صفحات  -

تاریخ انتشار 2015