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RMG-database - A chemistry database for RMG

Authors: Prof. William H. Green ([email protected]), Prof. Richard H. West ([email protected]) and the RMG Team ([email protected])

This repository contains the database of chemical information used by Reaction Mechanism Generator (RMG) to determine the chemical parameters needed by its generated chemistry models.

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RMG-database with uncertainty quantification

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  • Python 98.6%
  • Jupyter Notebook 1.4%