Exergy analysis of the diesel pre-reforming solid oxide fuel cell system with anode off-gas recycling in the SchIBZ project. Part I: Modeling and validation G Valadez Huerta, J Jordán Álvarez, M Dragon, K Leites, S Kabelac
International Journal of Hydrogen Energy 43 (34), 16684-16693, 2018
44 * 2018 Modeling a thermocell with proton exchange membrane and hydrogen electrodes T Marquardt, G Valadez Huerta, S Kabelac
International Journal of Hydrogen Energy 43 (43), 19841-19850, 2018
12 2018 Local entropy production rates in a polymer electrolyte membrane fuel cell M Siemer, T Marquardt, G Valadez Huerta, S Kabelac
Journal of Non-Equilibrium Thermodynamics 42 (1), 1-30, 2017
12 2017 A phenomenological study of yttria-stabilized zirconia at 1300 K with the Green-Kubo formulation and equilibrium molecular dynamics G Valadez Huerta, A Kelle, S Kabelac
Chemical Physics 485, 108-117, 2017
10 2017 A Diffusivity Study of (Sc2 O3 )0.1 (CeO2 )0.01 (ZrO2 )0.89 between 1100 and 1500 K at Zero Pressure with Molecular Dynamics G Valadez Huerta, L Reus, S Kabelac
Journal of Chemical & Engineering Data 63 (6), 1955-1960, 2018
6 2018 Impact of Multi-Causal Transport Mechanisms in an Electrolyte Supported Planar SOFC with (ZrO2 )x−1 (Y2 O3 )x Electrolyte G Valadez Huerta, V Flasbart, T Marquardt, P Radici, S Kabelac
Entropy 20 (6), 469, 2018
5 2018 Molecular dynamics of electric-field driven ionic systems using a universal neural-network potential K Hisama, GV Huerta, M Koyama
Computational Materials Science 218, 111955, 2023
4 2023 Cyber Catalysis: N G Valadez Huerta, K Hisama, K Sato, K Nagaoka, M Koyama
arXiv e-prints, arXiv: 2208.13385, 2022
4 * 2022 Calculations of Real-System Nanoparticles Using Universal Neural Network Potential PFP G Valadez Huerta, Y Nanba, I Kurata, K Nakago, S Takamoto, ...
arXiv e-prints, arXiv: 2107.00963, 2021
4 * 2021 Genetic Parameterization of Interfacial Force Fields Based on Classical Bulk Force Fields and Ab Initio Data: Application to the Methanol-ZnO Interfaces G Valadez Huerta, G Raabe
Journal of Chemical Information and Modeling 60 (12), 6033-6043, 2020
4 2020 A novel method to determine the transport coefficients of an YSZ electrolyte based on impedance spectroscopy P Radici, G Valadez Huerta, N Geesmann, S Kabelac
Solid State Ionics 363, 115591, 2021
3 2021 Approach to the Coulomb Contribution of Thermodynamic Properties from the Mean Electrostatic Potential of the Ions in (ZrO 2 )1–x (Y 2 O 3 )x G Valadez Huerta, M Siemen, S Kabelac
The Journal of Physical Chemistry C 122 (1), 62-70, 2018
3 2018 Machine Learning-Based Approaches in Nanoparticle Catalysis GV Huerta, K Hisama, Y Nanba, M Koyama
Elsevier, 2023
2023 CO Adsorption on Ternary Nanoalloys by Universal Neural Network Potential A TAMURA, GV HUERTA, Y NANBA, K HISAMA, M KOYAMA
Journal of Computer Chemistry, Japan 21 (4), 129-133, 2022
2022 First-Principles Calculations of Stability, Electronic Structure, and Sorption Properties of Nanoparticle Systems G Valadez Huerta, Y Nanba, NDB Zulkifli, DS Rivera Rocabado, ...
Journal of Computer Chemistry, Japan 20 (2), 23-47, 2021
2021 Modelling and Simulation of the Transport Mechanisms in Solid Oxide Fuel Cells with Molecular Dynamics and Non-equilibrium Thermodynamics G Valadez Huerta
Gottfried Wilhelm Leibniz Universität Hannover, 2019
2019 Schlussbericht M DRAGON, S KABELAC, GV HUERTA
2013 