Jialiang Dong1,2, Xuemao Dong3,4, Zhongxue Feng3,4,*, Caiju Li3,4, Jianhong Yi3,4, Jun Tan5,*
CMC-Computers, Materials & Continua, Vol.83, No.1, pp. 65-77, 2025, DOI:10.32604/cmc.2025.059727
- 26 March 2025
Abstract To explore atomic-level phenomena in the Cu-Ni-Sn alloy, a second nearest-neighbor modified embedded-atom method (2NN MEAM) potential has been developed for the Cu-Ni-Sn system, building upon the work of other researchers. This potential demonstrates remarkable accuracy in predicting the lattice constant, with a relative error of less than 0.5% when compared to density functional theory (DFT) results, and it achieves a 10% relative error in the enthalpy of formation compared to experimental data, marking substantial advancements over prior models. The bulk modulus is predicted with a relative error of 8% compared to DFT. Notably, the More >