published Published about 2 months ago
AQEval: R code for the analysis of discrete change in air quality time-series
R
published Published almost 2 years ago
doped: Python toolkit for robust and repeatable charged defect supercell calculations
Python Ruby Jupyter Notebook
published Published about 2 years ago
pymatgen-analysis-defects: A Python package for analyzing point defects in crystalline materials
Python Jupyter Notebook
published Published over 3 years ago
ShakeNBreak: Navigating the defect configurational landscape
Python Roff
published Published about 6 years ago

