Force-based many-body interatomic potential for ZrC A classical potential for ZrC is developed in the form of a modified second-moment approximation with emphasis on the strong directional dependence of the C–Zr interactions
Force-based many-body interatomic potential for ZrC Based on the discussion in Sec II, a more plausible physical mechanism can be proposed to explain the C–C force constants in ZrC without resorting to direct C–C bonding
Force-based many-body interatomic potential for ZrC A simple analytic model that extends the Lennard-Jones potential into the many-body regime is proposed The two parameter model draws on the embedded-atom method formalism
Force-based many-body interatomic potential for ZrC - ADS We believe our model should be a good template for metallic ceramics A classical potential for ZrC is developed in the form of a modified second-moment approximation with emphasis on the strong directional dependence of the C-Zr interactions
Force-Based Many-Body Interatomic Potential for ZrC A classical potential for ZrC is developed in the form of a modified second-moment approximation with emphasis on the strong directional dependence of the C–Zr interactions
Many-Body Interatomic Potential for Refractory Carbides - Ju Li We have developed a robust many-body interatomic potential expression for refractory carbides Although we have only parameterized ZrC, the same form is expected to perform well on TiC, HfC, TaC and NbC
Force-based many-body interatomic potential for ZrC A classical potential for ZrC is developed in the form of a modified second-moment approximation with emphasis on the strong directional dependence of the C–Zr interactions
Interatomic Potentials Repository - NIST This repository provides a source for interatomic potentials (force fields), related files, and evaluation tools to help researchers obtain interatomic models and judge their quality and applicability