Scientific Software
Updated 9 months ago

doped — Peer-reviewed • Rank 15.8 • Science 95%

doped: Python toolkit for robust and repeatable charged defect supercell calculations - Published in JOSS (2024)

Scientific Software
Updated 9 months ago

ShakeNBreak — Peer-reviewed • Rank 14.3 • Science 77%

ShakeNBreak: Navigating the defect configurational landscape - Published in JOSS (2022)