symd

• Getting Started
  • Changelog
• Change Log
  • v1.1.2 (2022-11-20)
  • v1.1.0 (2022-6-26)
  • v1.0.2 (2022-4-4)
  • v1.0.1 (2022-4-3)
  • v1.0.0 (2022-4-3)
• Python Tutorial
  • A group
    • Group Elements
    • Asymmetric unit
  • Fractional vs Euclidean Coordinates
  • Bravais Lattice
• Custom Symmetry Group Example
  • Make custom group
  • Run
• Figure 1 from Paper
  • All Sims
• Figure 2 From Paper
  • Make Atlas
  • Plot Figure
  • TOC
• API
  • Symd
    • Symd.clean_files()
    • Symd.log_output()
    • Symd.log_positions()
    • Symd.number_density()
    • Symd.read_cell()
    • Symd.read_positions()
    • Symd.remove_overlap()
    • Symd.run()
    • Symd.setup_masses()
    • Symd.shrink()
  • Group
    • Group.asymm_unit
    • Group.genpos
    • Group.lattice
    • Group.name
    • Group.specpos
  • asymm_constraints()
  • cell_nparticles()
  • cell_volume()
  • get_cell()
  • group_names
  • load_group()
  • prepare_input()
  • project_cell()
  • str2mat()