Defects Python Packages

codechecker

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

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.

easyunfold

Band structure unfolding made easy!

cdi-stools

Coherent Diffraction Imaging Simulation Tools — BCDI simulation and NN-based phase retrieval

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

Shared API stub types package for the CodeChecker API.

codechecker-api

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

devml

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

b-fade

B-FADE: Bayesian FAtigue moDel Estimator