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Condensed Matter > Materials Science

arXiv:1610.02054 (cond-mat)
[Submitted on 6 Oct 2016 (v1), last revised 17 Nov 2016 (this version, v2)]

Title:Frequency estimate for multicomponent crystalline compounds

Authors:M. Widom
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Abstract:Among crystal structures of N-component metal alloys, far fewer examples are known with N>=4 than with N=2 or 3, in apparent contradiction to the exponentially growing number of possible combinations of elements. Two effects contribute to this shortfall. Since the N-component composition space resides within a d-dimensional simplex with d=N-1, the vanishing volume in high dimensions reduces the distinct N-component compositions. Additionally, the increasing surface area makes it more probable that stable structures reside on the surface of the simplex (containing fewer than N components) as opposed to its interior. Despite their rarity, we propose that the actual number of N=4- and 5-component alloys greatly exceeds the number that are currently known. Specific estimates are developed through application of the empirical Miedema enthalpy model.
Comments: Revised version submitted to J. Stat. Phys. (2016)
Subjects: Materials Science (cond-mat.mtrl-sci)
Cite as: arXiv:1610.02054 [cond-mat.mtrl-sci]
  (or arXiv:1610.02054v2 [cond-mat.mtrl-sci] for this version)
  https://doi.org/10.48550/arXiv.1610.02054
arXiv-issued DOI via DataCite
Related DOI: https://doi.org/10.1007/s10955-016-1680-z
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Submission history

From: Michael Widom [view email]
[v1] Thu, 6 Oct 2016 20:13:55 UTC (25 KB)
[v2] Thu, 17 Nov 2016 14:42:48 UTC (29 KB)
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