Open-Catalyst-Project/Open-Catalyst-Dataset

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MIT License
Created over 4 years ago
Updated 6 months ago

Open-Catalyst-Project/Open-Catalyst-Dataset

Open-Catalyst-Project

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Workflow for creating and analyzing the Open Catalyst Dataset

ocp

Open Catalyst Project's library of machine learning methods for catalysis

AdsorbML

Corresponding dataset and tools for the AdsorbML manuscript.

Jupyter Notebook

ocpapi

om-data

Jupyter Notebook

tutorial

Tutorials on using OCP

Jupyter Notebook

odac-data