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PytLab
VASPy PytLab
97
277
mit
20
Manipulating VASP files with Python.
vasp chemistry data-processing data-visualization catalysis-informatics computational-chemistry
Created 2015-08-04
612 commits to master branch, last one 2 years ago
SUNCAT-Center
CatKit SUNCAT-Center
53
91
gpl-3.0
12
General purpose tools for high-throughput catalysis
catalyst combinatorics chemical-kinetics materials-science chemical-engineering catalysis-informatics materials-informatics computational-chemistry chemical-reaction-networks
Created 2017-10-10
257 commits to master branch, last one 2 years ago