PeriodicGraphEmbeddings.jl

Extension of PeriodicGraphs.jl for euclidean embeddings and symmetry considerations
Author Liozou
Popularity
3 Stars
Updated Last
6 Months Ago
Started In
April 2022

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.

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