Repositories list

• SHRY

  Public
  SHRY (Suite for High-throughput generation of models with atomic substitutions implemented by python) is a tool for generating unique ordered structures corresponding to a given disordered structure.

  high-performance-computingelectronic-structureab-initio-simulations+ 1high-entropy-alloys

  Python

  •

  MIT License

  •1•7•0•1•Updated Jan 30, 2024Jan 30, 2024

• aiida-shry

  Public
  aiida-shry

  MIT License

  •0•0•0•0•Updated Oct 31, 2023Oct 31, 2023