29 citations · 41 across the 3 of their papers we have counts for
3 papers
The influence of alloying on the stacking fault energy of gold from density functional theory calculations
Anuj Goyal, Yanzhong Li, Aleksandr Chernatynskiy +4
The generalized stacking fault (SFE) energy curves of pure gold (Au) and its binary alloys with transition metals are determined from density functional theory (DFT). Alloy element…
Dynamics of Graphene/Al Interfaces using COMB3 Potentials
Difan Zhang, Alexandre F. Fonseca, Tao Liang +2
This work describes the development of a third-generation charge optimized many-body (COMB3) potential for Al-C and its application to the investigation of aluminum/graphene nanost…
Multiferroic Thermodynamics
G. R. Boyd, P. Kumar, S. R. Phillpot
We have studied the thermodynamic properties of a multiferroic that couples ferromagnetic and ferroelectric order. Some of the results are independent of the form of the free energ…