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CatKit
CatKit PublicForked from SUNCAT-Center/CatKit
General purpose tools for high-throughput catalysis
Python
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CatLearn
CatLearn PublicForked from SUNCAT-Center/CatLearn
A machine learning environment for atomic-scale modeling in surface science and catalysis.
Python
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catmap
catmap PublicForked from SUNCAT-Center/catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
Python
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cgcnn
cgcnn PublicForked from txie-93/cgcnn
Crystal graph convolutional neural networks for predicting material properties.
Python
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