Publications by authors named "F Gygi"

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A single-GPU implementation of first-principles molecular dynamics.
François Gygi

J Chem Phys· October 2025

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Author Correction: Engineering the formation of spin-defects from first principles.
Cunzhi Zhang, Francois Gygi, Giulia Galli

Nat Commun· July 2024

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Raman Spectra of Electrified Si-Water Interfaces: First-Principles Simulations.
Zifan Ye, Francois Gygi, Giulia Galli

J Phys Chem Lett· January 2024

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Engineering the formation of spin-defects from first principles.
Cunzhi Zhang, Francois Gygi, Giulia Galli

Nat Commun· September 2023

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All-Electron Plane-Wave Electronic Structure Calculations.
François Gygi

J Chem Theory Comput· February 2023

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