Jon López-Zorrilla

Publication Activity (10 Years)

Years Active: 2023-2024
Publications (10 Years): 5

Top Topics

Density Functional Theory

Oxide Nanoparticles

Machine Learning

Top Venues

The Journal of chemical physics

Nature communications

Journal of chemical theory and computation

This page only lists publications with an associated author ORCID identifier.

Publications

Jon López-Zorrilla, Xabier M Aretxabaleta, Hegoi Manzano
Exploring the Polymorphism of Dicalcium Silicates Using Transfer Learning Enhanced Machine Learning Atomic Potentials. Journal of chemical theory and computation (2024)
Jon López-Zorrilla, Xabier M Aretxabaleta, In Won Yeu, Iñigo Etxebarria, Hegoi Manzano, Nongnuch Artrith
ænet-PyTorch: A GPU-supported implementation for machine learning atomic potentials training. The Journal of chemical physics 158 (16) (2023)
Jon López-Zorrilla, Xabier M Aretxabaleta, In Won Yeu, Iñigo Etxebarria, Hegoi Manzano, Nongnuch Artrith
ænet-PyTorch: A GPU-supported implementation for machine learning atomic potentials training. The Journal of chemical physics 158 (16) (2023)
Xabier M Aretxabaleta, Jon López-Zorrilla, Iñigo Etxebarria, Hegoi Manzano
Multi-step nucleation pathway of C-S-H during cement hydration from atomistic simulations. Nature communications 14 (1) (2023)
Jon López-Zorrilla, Xabier M Aretxabaleta, In Won Yeu, Iñigo Etxebarria, Hegoi Manzano, Nongnuch Artrith
ænet-PyTorch: A GPU-supported implementation for machine learning atomic potentials training. The Journal of chemical physics 158 (16) (2023)