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Collection of Matlab codes to solve typical CRE (Chemical Reaction Engineering) problems
gusmaogabriels / catmap
Forked from medford-group/catmapCatalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
gusmaogabriels / ase-espresso
Forked from bencomer/ase-espressoase interface for Quantum Espresso
Optimization in Python: Linear and non-linear optimization methods.