Pair-interaction model fitted via linear regression to first-principles data accurately predicts configuration energies in three refractory HEAs and yields an expression for intrinsic energy fluctuation.
Widom, Modeling the structure and thermodynamics of high-entropy alloys, Journal of Materials Research 33 (2018) 2881–2898
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Chemical complexity in high entropy alloys: A pair-interaction perspective
Pair-interaction model fitted via linear regression to first-principles data accurately predicts configuration energies in three refractory HEAs and yields an expression for intrinsic energy fluctuation.