PeriodicGraphEmbeddings

Build Status Documentation Aqua QA

A Julia package for manipulating periodic graph embeddings in euclidean spaces, such as those representing atoms in a crystal.

Partly wraps the spglib library to provide symmetry detection for 3-periodic graphs.

See also:

  • PeriodicGraphs.jl for the all that relates to the periodic graph itself, irrespective of its euclidean embedding.
  • CrystalNets.jl for a dependent package specialized on crystal nets.