gmagoon/CanTherm
Calculate thermochemical and kinetic quantities from spectroscopic/quantum data.
Discovered public repositories for gmagoon in the GitHub catalog.
Calculate thermochemical and kinetic quantities from spectroscopic/quantum data.
The Java version of RMG: Reaction Mechanism Generator
A tool for checking molecular conformational equivalence within a user-specified tolerance
Visualisation tools for RMG to show reaction flux diagrams and reaction lists etc.
Python version of the amazing Reaction Mechanism Generator. A GIT fork of sourceforge's SVN repository
heat capacity fitting package
Converts a Cantera chem.cti file into a bunch of PrIMe thermo polynomial files (one per species)
compare Burcat's thermochemistry with PrIMe