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arxiv: 1306.2395 · v2 · pith:336DXAUKnew · submitted 2013-06-11 · ❄️ cond-mat.mtrl-sci

Pressure-induced softening as a common feature of framework structures that have negative thermal expansion

classification ❄️ cond-mat.mtrl-sci
keywords expansionnegativepressure-inducedsofteningthermalcommonfeatureframework
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Results of a series of molecular dynamics simulations of cubic siliceous zeolites suggest that pressure-induced softening -- the phenomenon in which a material becomes progressively more compressible under pressure -- is likely to be a common feature of framework materials that show negative thermal expansion. The correlation between the negative thermal expansion and the pressure-induced softening is investigated on the basis of thermodynamics.

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