pymatgen.analysis.defects.generators

Defect generators.

Functions

generate_all_native_defects(host[, ...])

Generate all native defects.

Classes

AntiSiteGenerator([symprec, angle_tolerance])	Generator of all anti-site defects.
ChargeInterstitialGenerator([...])	Generator of interstitiald defects.
DefectGenerator()	Abstract class for a defect generator.
InterstitialGenerator([min_dist])	Generator of interstitiald defects.
SubstitutionGenerator([symprec, angle_tolerance])	Generator of substitutions for symmetry distinct sites in a structure.
VacancyGenerator([symprec, angle_tolerance])	Generator for vacancy defects.
VoronoiInterstitialGenerator([...])	Generator for interstitials based on a simple Voronoi.