#

open-catalyst-project

Here are 2 public repositories matching this topic...

sedaoturak / OC22_adsorption_energy

Notebook for calculating adsorption energy from the total energies in OC22 dataset.

ocp catalysts adsorption-energy catalyst-design open-catalyst-project

Updated Feb 5, 2026
Jupyter Notebook

Junhepark / Surface-Adsorption-and-Geometry-Evaluator-SAGE-

ML-assisted electrocatalyst screening workflow

computational-chemistry streamlit electrocatalysis open-catalyst-project catalyst-screening

Updated Aug 20, 2026
Python

Add this topic to your repo

To associate your repository with the open-catalyst-project topic, visit your repo's landing page and select "manage topics."