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1. VlachosGroup/SAC-Scaling-Laws VlachosGroup/SAC-Scaling-Laws Public

   Training Scaling Laws for Single-atom Catalysts on the Support Using Machine Learning

   Jupyter Notebook 7 4

2. VlachosGroup/Pdn-Cluster-Structure-Optimization VlachosGroup/Pdn-Cluster-Structure-Optimization Public

   Dataset, statistical learning-based energy model and structure optimization algorithms in Python for subnanometer Pd clusters supported on Ceria

   POV-Ray SDL 9 1

3. VlachosGroup/Fructose-HMF-Model VlachosGroup/Fructose-HMF-Model Public

   PFR model for the acid-catalyzed dehydration of fructose to HMF using HCl as the catalyst and generates the kinetic data for conversion, yield, and selectivity of the species as a function of tempe…

   Python 2 1

4. Py-Toolbox Py-Toolbox Public

   Python Toolbox for data science and computational catalysis

   Jupyter Notebook 2

5. VlachosGroup/Intro-to-KMC VlachosGroup/Intro-to-KMC Public

   Introduction to kinetic Monte Carlo (kMC) Simulations with Examples in Jupyter Notebooks

   Jupyter Notebook 26 7

6. Face-Mask-Type-Detector Face-Mask-Type-Detector Public

   Detecting whether a person is wearing a face mask and what type of mask they are wearing with TensorFlow and Raspberry Pi

   Jupyter Notebook 15 11