Browsing Computational File Repository by Author "Prins, S.N."

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    • Al–Pt First-principles calculations and thermodynamic modeling 

      Kim, D.E.; Liu, Z.-K.; Manga, V.R.; Prins, S.N. (2013-03-29)
      Thermodynamic description of the Al–Pt binary system is modeled by combining first-principles calculations with the CALPHAD method. The four-sublattice and two-sublattice compound energy formalisms are used to model the ...