LearnCK: mass conserving neural network reduction of chemistry and species of microkinetic models
Sashank Kasiraju, Dionisios G. Vlachos
Abstract
A Python-TensorFlow tool that learns chemical kinetics (LearnCK) for systematic and automatic reduction of microkinetic models using artificial neural networks (NNs).
Topics & Concepts
Artificial neural networkPython (programming language)Reduction (mathematics)Computer scienceArtificial intelligenceChemistryMachine learningMathematicsProgramming languageGeometryMachine Learning in Materials ScienceInnovative Microfluidic and Catalytic Techniques InnovationCatalysis and Oxidation Reactions