Jesús Carrete

According to our database, Jesús Carrete authored at least 10 papers between 2014 and 2026.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2026

msmJAX: Fast and differentiable electrostatics on the GPU in Python.

Florian Buchner, Johannes Schörghuber, Nico Unglert, Jesús Carrete, Georg K. H. Madsen

Comput. Phys. Commun., 2026

2025

Accelerating quantum Monte Carlo calculations with set-equivariant architectures and transfer learning.

Manuel Gallego, Sebastián Roca-Jerat, David Zueco, Jesús Carrete

Mach. Learn. Sci. Technol., 2025

2024

Clinamen2: Functional-style evolutionary optimization in Python for atomistic structure searches.

Ralf Wanzenböck, Florian Buchner, Péter Kovács, Georg K. H. Madsen, Jesús Carrete

Comput. Phys. Commun., 2024

2022

A Differentiable Neural-Network Force Field for Ionic Liquids.

Hadrián Montes-Campos, Jesús Carrete, Sebastian Bichelmaier, Luis M. Varela, Georg K. H. Madsen

J. Chem. Inf. Model., 2022

BTE-Barna: An extension of almaBTE for thermal simulation of devices based on 2D materials.

Martí Raya-Moreno, Xavier Cartoixà, Jesús Carrete

Comput. Phys. Commun., 2022

2021

Quantum Self-Consistent Ab-Initio Lattice Dynamics.

Ambroise van Roekeghem, Jesús Carrete, Natalio Mingo

Comput. Phys. Commun., 2021

2018

Vibrational Properties of Metastable Polymorph Structures by Machine Learning.

Fleur Legrain, Ambroise van Roekeghem, Stefano Curtarolo, Jesús Carrete, Georg K. H. Madsen, Natalio Mingo

J. Chem. Inf. Model., 2018

BoltzTraP2, a program for interpolating band structures and calculating semi-classical transport coefficients.

Georg K. H. Madsen, Jesús Carrete, Matthieu J. Verstraete

Comput. Phys. Commun., 2018

2017

almaBTE : A solver of the space-time dependent Boltzmann transport equation for phonons in structured materials.

Jesús Carrete, Bjorn Vermeersch, Ankita Katre, Ambroise van Roekeghem, Tao Wang, Georg K. H. Madsen, Natalio Mingo

Comput. Phys. Commun., 2017

2014

ShengBTE: A solver of the Boltzmann transport equation for phonons.

Wu Li, Jesús Carrete, Nebil A. Katcho, Natalio Mingo

Comput. Phys. Commun., 2014