Pareto-optimal alloys

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Abstract

A database consisting of the lattice parameters, bulk moduli, and heats of formation for over 64000 ordered metallic alloys, is presented. The use of the Pareto-optimal set to determine optical alloy solutions for the compromise between low compressibility, high stability, and cost, is outlined.

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Bligaard, T., Jóhannesson, G. H., Ruban, A. V., Skriver, H. L., Jacobsen, K. W., & Norskov, J. K. (2003). Pareto-optimal alloys. Applied Physics Letters, 83(22), 4527–4529. https://doi.org/10.1063/1.1631051

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