An improved sampling strategy for global energy minimization of multi-component systems-Reference-Cited by-同舟云学术

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An improved sampling strategy for global energy minimization of multi-component systems

Published:2017-04 Issue: Volume:130 Page:282-291
ISSN:0927-0256
Container-title:Computational Materials Science
language:en
Short-container-title:Computational Materials Science

Author:

Otis Richard,Emelianenko Maria,Liu Zi-Kui

Funder

NASA Space Technology Research Fellowship

National Science Foundation

Publisher

Elsevier BV

Subject

Computational Mathematics,General Physics and Astronomy,Mechanics of Materials,General Materials Science,General Chemistry,General Computer Science

Reference27 articles.

1. The compound energy formalism;Hillert;J. Alloy. Compd.,2001

2. Computer Calculation of Phase Diagrams;Kaufman,1970

3. A brief history of CALPHAD;Spencer;Calphad,2008

4. Some viewpoints on the use of a computer for calculating phase diagrams;Hillert;Phys. B+C,1981

5. Straegies for the calculation of phase diagrams;Lukas;Calphad,1982

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3. Thermodynamic Modeling with Uncertainty Quantification Using the Modified Quasichemical Model in Quadruplet Approximation: Implementation into PyCalphad and ESPEI;SSRN Electronic Journal;2022

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