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Citation: Y.-K. Kim, W.-S. Jung, and B.-J. Lee (2015), "Modified embedded-atom method interatomic potentials for the Ni-Co binary and the Ni-Al-Co ternary systems", Modelling and Simulation in Materials Science and Engineering, 23(5), 055004. DOI: 10.1088/0965-0393/23/5/055004.
Abstract: Interatomic potentials for the Ni-Co binary and Ni-Al-Co ternary systems have been developed on the basis of the second nearest-neighbor modified embedded-atom method (2NN MEAM) formalism. The potentials describe structural, thermodynamic, deformation and defect properties of solid solution phases or compound phases in reasonable agreements with experiments or first-principles calculations. The results demonstrate the transferability of the potentials and their applicability to large-scale atomistic simulations to investigate the effect of an alloying element, cobalt, on various microstructural factors related to mechanical properties of Ni-based superalloys on an atomic scale.

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Notes: These potential files were obtained from http://cmse.postech.ac.kr/home_2nnmeam, accessed Nov 9, 2020.
Date Created: October 5, 2010 | Last updated: July 09, 2021