Defects Python Packages

doped

doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defect simulation workflow in an efficient, reproducible, user-friendly yet powerful and fully-customisable manner.

codechecker

CodeChecker is an analyzer tooling, defect database and viewer extension for static and dynamic analyzer tools.

easyunfold

Band structure unfolding made easy!

codechecker-api

CodeChecker is an analyzer tooling, defect database and viewer extension for static and dynamic analyzer tools.

aiida-kkr

AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.

codechecker-api-shared

CodeChecker is an analyzer tooling, defect database and viewer extension for static and dynamic analyzer tools.

nonrad

Implementation for computing nonradiative recombination rates in semiconductors

b-fade

B-FADE: Bayesian FAtigue moDel Estimator

devml

Product of Pragmatic AI Labs: Machine Learning, Statistics and Utilities around Developer Productivity, Company Productivity and Project Productivity