Brandon C. Wood

An Introduction to Electrocatalyst Design using Machine Learning for Renewable Energy Storage pdf

C. Lawrence Zitnick, Aini Palizhati, Zachary W. Ulissi, 2020, ArXiv.

The Open Catalyst 2020 (OC20) Dataset and Community Challenges pdf

C. Lawrence Zitnick, Aini Palizhati, Kevin Tran, 2020, Proceedings of the International Conference on Electrocatalysis for Energy Applications and Sustainable Chemicals.

Open Challenges in Developing Generalizable Large-Scale Machine-Learning Models for Catalyst Discovery

Zachary W. Ulissi, C. L. Zitnick, Abhishek Das, 2022, ACS Catalysis.

Spherical Channels for Modeling Atomic Interactions

Zachary W. Ulissi, C. L. Zitnick, Janice Lan, 2022, ArXiv.

Correction to “The Open Catalyst 2020 (OC20) Dataset and Community Challenges”

Zachary W. Ulissi, C. L. Zitnick, Anuroop Sriram, 2021, ACS Catalysis.

Accurate, Automated Density Functional Theory for Complex Molecules Using On-the-fly Error Correction

Samuel M. Blau, Kristin A. Persson, Brandon C. Wood, 2020 .

The Open Catalyst 2020 (OC20) Dataset and Community Challenges

Weihua Hu, C. Lawrence Zitnick, Aini Palizhati, 2020, ACS Catalysis.

Efficient and universal characterization of atomic structures through a topological graph order parameter

Brandon C. Wood, James Chapman, N. Goldman, 2022, npj Computational Materials.

Open Catalyst 2020 (OC20) Dataset and Community Challenges

Zachary W. Ulissi, C. L. Zitnick, Anuroop Sriram, 2020, ACS Catalysis.

Spherical Channels for Modeling Atomic Interactions

Zachary W. Ulissi, C. L. Zitnick, Janice Lan, 2022, NeurIPS.