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arxiv: 1906.01085 · v1 · pith:QX7PXF6Gnew · submitted 2019-06-03 · ❄️ cond-mat.mtrl-sci

Unavoidable disorder and entropy in multi-component systems

classification ❄️ cond-mat.mtrl-sci
keywords enthalpyentropygainspeciesdisorderincreasingmulti-componentnumber
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The need for improved functionalities is driving the search for more complicated multi-component materials. Despite the factorially increasing composition space, ordered compounds with 4 or more species are rare. Here, we unveil the competition between the gain in enthalpy and entropy with increasing number of species by statistical analysis of the AFLOW data repositories. A threshold in the number of species is found where entropy gain exceeds enthalpy gain. Beyond that, enthalpy can be neglected, and disorder - complete or partial - is unavoidable.

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