Cao, Weisheng

Chen, Shuanglin

Zhang, Chuan

Zhang, Fan

Zhu, Jun

English

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8th International Conference on Physical and Numerical Simulation of Materials Processing (ICPNS)14–17 October 2016Seattle, Washington | Hosted by Purdue UniversitySESSION 1: MODELS AND METHODS, SALON ACo-Chairs: Wei Xiong, University of Pittsburgh; Lingti Kong, Shanghai Jiao Tong University; Jiawei Mi, Lars-Erik Lindgren, Lulea University of TechnologySATURDAY, OCTOBER 15, 2016Calculation of thermodynamic and physical properties in  multi-component systemsShuanglin Chen; Weisheng Cao; Fan Zhang; Chuan Zhang; Chuan Zhang, CompuThermABSTRACTThermodynamic and physical properties are important for understanding other materials properties. Calculations of various properties, such as activity, partial pressure, and density, will be presented. Calculation is based on CALPHAD approach. A property could be calculated as a function of one variable (1D calculation) or as a function of two variables (2D contour diagram). Optimal property in a multi-component system could be searched by the brute-force method or other optimization algorithms.KEYWORDS: thermodynamic properties, physical properties, CALPHAD, contour diagram

Calculation of thermodynamic and physical properties in multi-component systems

https://docs.lib.purdue.edu/cgi/viewcontent.cgi?article=1144&amp;context=icpns

Calculation of thermodynamic and physical properties in multi-component systems

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