• License: MIT
• Home: https://github.com/oekosheri/GB_code
• Development: https://github.com/oekosheri/GB_code
• Documentation: https://github.com/oekosheri/GB_code
• 3117 total downloads
• Last upload: 4 months and 24 days ago

Description

This python package helps you create orthogonal grain boundary supercells for atomistic calculations. The code is based on the coincident site lattice (CSL) formulations for cubic materials (sc, bcc, fcc, diamond).