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Symmetric Molecular Dynamics
- Publication Year :
- 2022
-
Abstract
- 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.
- Subjects :
- Condensed Matter - Statistical Mechanics
Physics - Chemical Physics
Subjects
Details
- Database :
- arXiv
- Publication Type :
- Report
- Accession number :
- edsarx.2204.01114
- Document Type :
- Working Paper