matscipy

Table of Contents

  • matscipy
  • Application domains
  • Analysis tools
    • Neighbour list
    • Pair-distribution function
    • Angle-distribution function
    • Ring analysis
  • Interatomic potentials
  • Structure and topology generation
  • Command line interface
  • API Reference
matscipy
  • Analysis tools
  • View page source

Analysis tools

matscipy contains general utility functionality which is widely applicable.

  • Neighbour list
    • Basic usage
    • Per-atom properties
    • Interatomic potential
  • Pair-distribution function
    • Real-space
    • Fourier space
  • Angle-distribution function
  • Ring analysis
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