论文标题
对称分子动力学
Symmetric Molecular Dynamics
论文作者
论文摘要
我们得出一个仅生成对称配置的分子动力学的公式。我们将其用于所有2D平面和3D空间组。用对称分子动力学创建了所有平面组下2D Lennard-Jones晶体的地图集。
We derive a formulation of molecular dynamics that generates only symmetric configurations. We implement it for all 2D planar and 3D space groups. An atlas of 2D Lennard-Jones crystals under all planar groups is created with symmetric molecular dynamics.
