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Alfonso Gijón
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Year
Paths towards equilibrium in molecular systems: The case of water
A Gijón, A Lasanta, ER Hernández
Physical Review E 100 (3), 032103, 2019
482019
Physics-informed neural networks for data-driven simulation: Advantages, limitations, and opportunities
FF de la Mata, A Gijón, M Molina-Solana, J Gómez-Romero
Physica A: Statistical Mechanics and its Applications 610, 128415, 2023
402023
Wave packet calculations of the quantum transport of atoms through nanoporous membranes
A Gijón, J Campos-Martínez, MI Hernández
The Journal of Physical Chemistry C 121 (36), 19751-19757, 2017
292017
Translucency of graphene to van der Waals forces applies to atoms/molecules with different polar character
F Presel, A Gijon, ER Hernandez, P Lacovig, S Lizzit, D Alfe, A Baraldi
ACS nano 13 (10), 12230-12241, 2019
132019
Bibliometric analysis of the global scientific production on machine learning applied to different cancer types
MA Ruiz-Fresneda, A Gijón, P Morales-Álvarez
Environmental Science and Pollution Research 30, 96125–96137, 2023
122023
Prediction of wind turbines power with physics-informed neural networks and evidential uncertainty quantification
A Gijón, A Pujana-Goitia, E Perea, M Molina-Solana, J Gómez-Romero
arXiv preprint arXiv:2307.14675, 2023
72023
Quantum simulations of neutral water clusters and singly-charged water cluster anions
A Gijón, ER Hernández
Physical Chemistry Chemical Physics 24 (23), 14440-14451, 2022
52022
Can Deep Learning Search for Exceptional Chiroptical Properties? The Halogenated [6] Helicene Case
R García Uceda, A Gijón, S Miguez-Lago, CM Cruz, V Blanco, ...
Angewandte Chemie, e202409998, 2024
42024
Quantum molecular simulations of micro-hydrated halogen anions
R Rodríguez-Segundo, A Gijón, R Prosmiti
Physical Chemistry Chemical Physics 24, 14964-14974, 2022
42022
Classical and quantum molecular dynamics simulations of condensed aqueous systems
A Gijón Gijón
Universidad Autónoma de Madrid, 2021
42021
Explainable Hybrid Semi-parametric Model for Prediction of Power Generated by Wind Turbines
A Gijón, S Eiraudo, A Manjavacas, L Bottaccioli, A Lanzini, ...
International Conference on Computational Science, 299-306, 2024
22024
Graph-neural-network potential energy surface to speed up Monte Carlo simulations of water cluster anions
A Gijón, M Molina-Solana, J Gómez-Romero
Journal of Computational Science 81, 102383, 2024
12024
Graph Neural Network Potentials for Molecular Dynamics Simulations of Water Cluster Anions
A Gijón, M Molina-Solana, J Gómez-Romero
International Conference on Computational Science, 336-343, 2023
12023
Integrating Physics and Data-Driven Approaches: An Explainable and Uncertainty-Aware Hybrid Model for Wind Turbine Power Prediction
A Gijón, S Eiraudo, A Manjavacas, DS Schiera, M Molina-Solana, ...
arXiv preprint arXiv:2502.07344, 2025
2025
Chiral Intelligence: The Artificial Intelligence‐Driven Future of Chiroptical Properties
RG Uceda, A Gijón, S Míguez‐Lago, CM Cruz, L Álvarez de Cienfuegos, ...
ChemPhotoChem, 2500079, 2025
2025
STIED: A deep learning model for the SpatioTemporal detection of focal Interictal Epileptiform Discharges with MEG
R Fernández-Martín, A Gijón, O Feys, E Juvené, A Aeby, C Urbain, ...
arXiv preprint arXiv:2410.23386, 2024
2024
Chain-of-states methods for finding minimum energy paths of transitions in poly-atomic systems
A Gijón, ER Hernández
XGEFES 2018 Meeting, 2018
2018
Three-dimensional wave packet calculations of the quantum transport of Helium atoms through nanoporous membranes
MI Hernández, A Gijón, J Campos-Martínez
MOLIM Workshop on Intermolecular Interactions (2017), 2017
2017
Three-dimensional wave-packet calculations of the quantum transport of atoms through nanoporous membranes
MI Hernández, A Gijón, J Campos-Martínez
The Joint Iberian Meeting on Atomic and Molecular Physics (IBER 2017), 2017
2017
Quantum-Mechanical Simulations of the Transport of Atoms through Nanoporous Membranes
J Campos-Martínez, A Gijón, MI Hernández
XXXVI Reunión Bienal de la Real Sociedad Española de Física (2017), 2017
2017
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Articles 1–20