Lim, Jaehun Moon, Donghyeon Kim, Sunghyun Kim, Suenne
Published in
Nanotechnology
In computational studies using the Lennard–Jones (LJ) potential, the widely adopted 2.5 σ cutoff radius effectively truncates pairwise interactions across diverse systems (Santra et al 2008 J. Chem. Phys. 129 234704, Chen and Gao 2021 Friction 9 502–12, Bolintineanu et al 2014 Part. Mech. 1 321–56, Takahiro and Kazuhiro 2010 J. Phys.: Conf. Ser. 21...
Sun, Chenyang Zhang, Yaning Hou, Chaofeng Ge, Wei
The Lennard-Jones (LJ) potential function is widely employed in molecular dynamics simulations. In this study, the LJ potentials under different characteristic diameter sigma and characteristic energy epsilon were simulated, and the changes in properties such as number density, total energy, phase transition latent heat, and phase transition temper...
Sun, Chenyang Zhang, Yaning Hou, Chaofeng Ge, Wei
The Lennard-Jones (LJ) potential function is widely employed in molecular dynamics simulations. In this study, the LJ potentials under different characteristic diameter sigma and characteristic energy epsilon were simulated, and the changes in properties such as number density, total energy, phase transition latent heat, and phase transition temper...
Sun, Chenyang Zhang, Yaning Hou, Chaofeng Ge, Wei
Abstract The Lennard-Jones (LJ) potential function is widely employed in molecular dynamics simulations. In this study, the LJ potentials under different characteristic diameter σ and characteristic energy ε were simulated, and the changes in properties such as number density, total energy, phase transition latent heat, and phase transition tempera...
Sun, Chenyang Zhang, Yaning Hou, Chaofeng Ge, Wei
Published in
Physica Scripta
The Lennard-Jones (LJ) potential function is widely employed in molecular dynamics simulations. In this study, the LJ potentials under different characteristic diameter σ and characteristic energy ε were simulated, and the changes in properties such as number density, total energy, phase transition latent heat, and phase transition temperature were...
