published Published almost 5 years ago
pyrexMD: Workflow-Orientated Python Package for Replica Exchange Molecular Dynamics
Python
@ArtVoro
published Published almost 5 years ago
optimade-python-tools: a Python library for serving and consuming materials data via OPTIMADE APIs
Python
@ml-evs
published Published almost 5 years ago
Correlation: An Analysis Tool for Liquids and for Amorphous Solids
M4 C++
@Isurwars
@JohannesBuchner
published Published over 5 years ago
fuelcell: A Python package and graphical user interface for electrochemical data analysis
Python
@samaygarg
published Published over 5 years ago
GIMS: Graphical Interface for Materials Simulations
Python JavaScript
@kokookster
published Published almost 6 years ago
FHI-vibes: Ab Initio Vibrational Simulations
Python Jupyter Notebook Fortran
@flokno
published Published almost 6 years ago
matador: a Python library for analysing, curating and performing high-throughput density-functional theory calculations
Python
published Published almost 6 years ago
DiffCapAnalyzer: A Python Package for Quantitative Analysis of Total Differential Capacity Data
Python
@nicolet5
published Published about 6 years ago
@merrygoat
