Pablo Zubieta Rico

7PUBLICATIONS
9CO-AUTHORS
Chemical and thermal processes in energy and combustionStatistical mechanics in chemistrySemi- and unsupervised learningComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Fundamental and theoretical fluid dynamics
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Publications (7)

|Jun 12, 2025
Free-Energy Landscapes and Surface Dynamics in Methane Activation on Ni(511) via Machine Learning and Enhanced Sampling.

Yezhi Jin, Yinan Xu, Jireh S García Sánchez

|Feb 26, 2025
Efficient sampling of free energy landscapes with functions in Sobolev spaces.

Pablo F Zubieta Rico, Gustavo R Pérez-Lemus, Juan J de Pablo

|Dec 23, 2024
The importance of sampling the dynamical modes: Reevaluating benchmarks for invariant and equivariant features of machine learning potentials for simulation of free energy landscapes.

Gustavo Perez-Lemus, Yinan Xu, Yezhi Jin

|Sep 19, 2024
A Molecular View of Methane Activation on Ni(111) through Enhanced Sampling and Machine Learning.

Yinan Xu, Yezhi Jin, Jireh S García Sánchez

|Aug 16, 2024
Improving Machine Learned Force Fields for Complex Fluids through Enhanced Sampling: A Liquid Crystal Case Study.

Yezhi Jin, Gustavo R Perez-Lemus, Pablo F Zubieta Rico

|Nov 19, 2021
Non-equilibrium relaxation and aging in the dynamics of a dipolar fluid quenched towards the glass transition.

Ricardo Peredo-Ortiz, Pablo F Zubieta Rico, Ernesto C Cortés-Morales

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Frequent Collaborators

5 joint publications

Juan J de Pablo

3 joint publications

Yinan Xu

2 joint publications

Luis F Elizondo-Aguilera

2 joint publications

Massimiliano Delferro