Geoffroy Hautier

According to our database, Geoffroy Hautier authored at least 5 papers between 2015 and 2025.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2025

On The Finetuning of MLIPs Through the Lens of Iterated Maps With BPTT.

Evan Dramko, Yizhi Zhu, Aleksandar Krivokapic, Geoffroy Hautier, Thomas Reps, Christopher M. Jermaine, Anastasios Kyrillidis

CoRR, December, 2025

ADAPT: Lightweight, Long-Range Machine Learning Force Fields Without Graphs.

Evan Dramko, Yihuang Xiong, Yizhi Zhu, Geoffroy Hautier, Thomas Reps, Christopher M. Jermaine, Anastasios Kyrillidis

CoRR, September, 2025

2020

LOBSTER : Local orbital projections, atomic charges, and chemical-bonding analysis from projector-augmented-wave-based density-functional theory.

Ryky Nelson, Christina Ertural, Janine George, Volker L. Deringer, Geoffroy Hautier, Richard Dronskowski

J. Comput. Chem., 2020

2018

PyCDT: A Python toolkit for modeling point defects in semiconductors and insulators.

Danny Broberg, Bharat Medasani, Nils E. R. Zimmermann, Guodong Yu, Andrew Canning, Maciej Haranczyk, Mark Asta, Geoffroy Hautier

Comput. Phys. Commun., 2018

2015

FireWorks: a dynamic workflow system designed for high-throughput applications.

Anubhav Jain, Shyue Ping Ong, Wei Chen, Bharat Medasani, Xiaohui Qu, Michael Kocher, Miriam Brafman, Guido Petretto, Gian-Marco Rignanese, Geoffroy Hautier, Daniel K. Gunter, Kristin A. Persson

Concurr. Comput. Pract. Exp., 2015