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Formation enthalpies for transition metal alloys using machine learning
Author(s) -
Shashanka Ubaru,
Agnieszka Międlar,
Yousef Saad,
James R. Chelikowsky
Publication year - 2017
Publication title -
physical review. b./physical review. b
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.78
H-Index - 465
eISSN - 2469-9969
pISSN - 2469-9950
DOI - 10.1103/physrevb.95.214102
Subject(s) - intermetallic , enthalpy , variety (cybernetics) , thermodynamics , computer science , artificial intelligence , machine learning , binary number , feature selection , materials science , support vector machine , lasso (programming language) , algorithm , mathematics , alloy , physics , metallurgy , arithmetic , world wide web
Shashanka Ubaru,1,* Agnieszka Międlar,2,† Yousef Saad,1,‡ and James R. Chelikowsky3,§ 1Department of Computer Science and Engineering, University of Minnesota, Twin Cities, Minnesota 55455, USA 2Department of Mathematics, University of Kansas, Lawrence, Kansas 66045-7594, USA 3Center for Computational Materials, Institute for Computational Engineering and Science, and Departments of Physics and Chemical Engineering, University of Texas, Austin, Texas 78712, USA (Received 18 June 2016; revised manuscript received 14 February 2017; published 1 June 2017)

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