Time-Dependent Deep Learning Manufacturing Process Model for Battery Electrode Microstructure Prediction Diego E. Galvez-Aranda, Tan Le Dinh, Utkarsh Vijay, Franco M. Zanotto, Alejandro A. Franco Advanced Energy Materials, 2024 VOLTA: a tool for battery screening bridging the gap between virtual electrode materials and practical applications Antonio Carnevali, M. Rosa Palacin, Clare P. Grey and Alejandro A. Franco Energy Storage Materials, 2024 Toward high-performance energy and power battery cells with machine learning-based optimization of electrode manufacturing Marc Duquesnoy, Chaoyue Liu, Vishank Kumar, Elixabete Ayerbe and Alejandro A. Franco Journal of Power Sources, 2024 Influence of the mixing speed in the rheology of NMC622-based Li-ion battery electrode slurries Diana Zapata Dominguez, Jiahui Xu, Yasmina Boudjema, Siwar Ben Hadj Ali, Franco M. Zanotto and Alejandro A. Franco Journal of Power Sources Advances, 2024 Toward high-performance energy and power battery cells with machine learning-based optimization of electrode manufacturing Marc Duquesnoy; Chaoyue Liu; Vishank Kumar, Elixabete Ayerbe and Alejandro A; Franco Journal of Power Sources, 2024 Mesoscopic Model of Extrusion during Solvent-Free Li-Ion Battery Electrode Manufacturing Brayan Paredes-Goyes; Franco M. Zanotto; Victor Boudeville; Sylvie Grugeon; Loic Dupont; Alejandro A. Franco ChemPhysChem, 2023 Three-dimensional physical modeling of the wet manufacturing process of solid-state battery electrodes Mohammed Alabdali, Franco M. Zanotto, Marc Duquesnoy, Anna-Katharina Hatz, Duancheng Ma, Jérémie Auvergniot, Virginie Viallet, Vincent Seznec, Alejandro A. Franco Journal of Power Sources, 2023 Combining Virtual Reality with Mixed Reality for efficient training in Battery Manufacturing Lucie Denisart, Diana Zapata-Dominguez, Xavier David, Aubin Leclere, Romain Lelong, Chaoyue Liu, Jiahui Xu, Emilie Loup-Escande, Alejandro A. Franco Batteries & Supercaps, 2023 Computational Model for Predicting Particle Fracture During Electrode Calendering Jiahui Xu, Brayan Paredes-Goyes, Zeliang Su, Mario Scheel, Timm Weitkamp, Arnaud Demortière, Alejandro A. Franco Batteries & Supercaps, 2023 Modeling the 4D discharge of lithium-ion batteries with a multiscale time-dependent deep learning framework Agnese Marcato , Javier E. Santos , Chaoyue Liu , Gianluca Boccardo , Daniele Marchisio , Alejandro A. Franco Energy Storage Materials, 2023 Impact of the manufacturing process on graphite blend electrodes with silicon nanoparticles for lithium-ion batteries Diana Zapata Dominguez, Brinti Mondal, Miran Gaberscek, Mathieu Morcrette, Alejandro A. Franco Journal of Power Sources, 2023 Carbonyl-Based Redox-Active Compounds as Organic Electrodes for Batteries: Escape from Middle–High Redox Potentials and Further Improvement? Fanny Lambert, Yann Danten, Carlo Gatti, Bryan Bocquet, Alejandro A. Franco, and Christine Frayret The Journal of Physical Chemistry A, 2023 Global and Local Structure of Lithium Battery Electrolytes: Origin and Onset of Highly Concentrated Electrolyte Behavior Fabian Årén, Rasmus Andersson, Alejandro A. Franco, Patrik Johansson Journal of The Electrochemical Society, 2023 Optimization of the microstructure of carbon felt electrodes by applying the lattice Boltzmann method and Bayesian optimizer Jia Yu, Marc Duquesnoy, Chaoyue Liu, Alejandro A. Franco Journal of Power Sources, 2023 Machine learning for optimal electrode wettability in lithium ion batteries Amina El Malki, Mark Asch, Oier Arcelus, Abbos Shodiev, Jia Yu, Alejandro A. Franco Journal of Power Sources Advances, 2023 LIBAC: An Annotated Corpus for Automated “Reading” of the Lithium-Ion Battery Research Literature Hassna El-Bousiydy, Javier F. Troncoso, Patrik Johansson, and Alejandro A. Franco Chemistry of Materials, 2023 Electrochemistry Visualization Tool to Support the Electrochemical Analysis of Batteries Matheus Leal de Souza, Marc Duquesnoy, Mathieu Morcrette, Alejandro A. Franco Batteries & Supercaps, 2023 Machine Learning-Assisted Multi-Objective Optimization of Battery Manufacturing from Synthetic Data Generated by Physics-Based Simulations Marc Duquesnoy, Chaoyue Liu, Diana Zapata Dominguez, Vishank Kumar, Elixabete Ayerbe, Alejandro A. Franco Energy Storage Materials, 2023 Coupling of multiscale imaging analysis and computational modeling for understanding thick cathode degradation mechanisms Minghao Zhang, Mehdi Chouchane, S. Ali Shojaee, Bartlomiej Winiarski, Zhao Liu, Letian Li, Rengarajan Pelapur, Abbos Shodiev, Weiliang Yao, Jean-Marie Doux, Shen Wang, Yixuan Li, Chaoyue Liu, Herman Lemmens, Alejandro A. Franco, Ying Shirley Meng Joule, 2023 Lithium ion battery electrode manufacturing model accounting for 3D realistic shapes of active material particles Jiahui Xu, Alain C. Ngandjong, Chaoyue Liu, Franco M. Zanotto, Oier Arcelus, Arnaud Demortière, Alejandro A. Franco Journal of Power Sources, 2023 From Battery Manufacturing to Smart Grids: Towards a Metaverse for the Energy Sciences Alejandro A. Franco, Emilie Loup-Escande, Goran Loiseaux, Jean-Noel Chotard, Diana Zapata-Dominguez, Jan Ciger, Aubin Lecrere, Lucie Denisart, Romain Lelong Batteries & Supercaps, 2023 An Experimentally-Validated 3D Electrochemical Model Revealing Electrode Manufacturing Parameters’ Effects on Battery Performance Chaoyue Liu, Teo Lombardo, Jiahui Xu, Alain C. Ngandjong, Alejandro A. Franco Energy Storage Materials, 2023 Microstructurally Resolved Modeling of All Solid-State Batteries: Latest Progresses, Opportunities and Challenges Mohammed Alabdali, Franco M. Zanotto, Virginie Viallet, Vincent Seznec, Alejandro A. Franco Current Opinion in Electrochemistry, 2022 About the Consideration of the Inactive Materials and the Meshing Procedures in Computational Models of Lithium Ion Battery Electrodes Mehdi Chouchane, Alejandro A. Franco ChemElectroChem, 2022 Functional data-driven framework for fast forecasting of electrode slurry rheology simulated by molecular dynamics Marc Duquesnoy, Teo Lombardo, Fernando Caro, Florent Haudiquez, Alain C. Ngandjong, Jiahui Xu, Hassan Oularbi, Alejandro A. Franco npj computational materials, 2022 Data Specifications for Battery Manufacturing Digitalization: Current Status, Challenges, and Opportunities Franco Martín Zanotto, Diana Zapata Dominguez, Elixabete Ayerbe, Iker Boyano, Christine Burmeister, Marc Duquesnoy, Marlene Eisentraeger, Jonathan Florez Montaño, Alfonso Gallo-Bueno, Lukas Gold, Florian Hall, Nicolaj Kaden, Bernhard Muerkens, Laida Otaegui, Yvan Reynier, Simon Stier, Matthias Thomitzek, Artem Turetskyy, Nicolas Vallin, Jacob Wessel, Xukuan Xu, Jeyhun Abbasov, Alejandro A. Franco Batteries & Supercaps, 2022 Gaining Insight into the Electrochemical Interface Dynamics in an Organic Redox Flow Battery with a Kinetic Monte Carlo Approach Jia Yu, Garima Shukla, Rocco Peter Fornari, Oier Arcelus, Abbos Shodiev, Piotr de Silva, Alejandro A. Franco Small, 2022 Rechargeable Batteries of the Future—The State of the Art from a BATTERY 2030+ Perspective Maximilian Fichtner, Kristina Edström, Elixabete Ayerbe, Maitane Berecibar, Arghya Bhowmik, Ivano E. Castelli, Simon Clark, Robert Dominko, Merve Erakca, Alejandro A. Franco, Alexis Grimaud, Birger Horstmann, Arnulf Latz, Henning Lorrmann, Marcel Meeus, Rekha Narayan, Frank Pammer, Janna Ruhland, Helge Stein, Tejs Vegge, Marcel Weil Advanced Energy Materials, 2022 Digitalization of Battery Manufacturing: Current Status, Challenges, and Opportunities Elixabete Ayerbe, Maitane Berecibar, Simon Clark, Alejandro A. Franco, Janna Ruhland Advanced Energy Materials, 2022 Bridging nano- and microscale X-ray tomography for battery research by leveraging artificial intelligence Jonathan Scharf, Mehdi Chouchane, Donal P. Finegan, Bingyu Lu, Christopher Redquest, Min-cheol Kim, Weiliang Yao, Alejandro A. Franco, Dan Gostovic, Zhao Liu, Mark Riccio, František Zelenka, Jean-Marie Doux & Ying Shirley Meng Nature Nanotechnology, 2022 Artificial Intelligence in Electrochemical Energy Storage Prof. Dr. Alejandro A. Franco, Prof. Dr. Amanda S. Barnard Batteries & Supercaps, 2022 Pore size distribution of carbon black: An approach from a coarse-grained potential Patricio Vélez, Guillermina L. Luque, Daniel E. Barraco, Alejandro A. Franco, Ezequiel P.M.Leiva Computational Materials Science, 2022 Designing Electrode Architectures to Facilitate Electrolyte Infiltration for Lithium-Ion Batteries Abbos Shodiev, Franco M. Zanotto, Jia Yu, Mehdi Chouchane, Jianlin Li, Alejandro A. Franco Energy Storage Materials, 2022 Experimentally Validated Three-Dimensional Modeling of Organic-Based Sodium-Ion Battery Electrode Manufacturing Teo Lombardo, Fanny Lambert, Roberto Russo, Franco M. Zanotto, Christine Frayret, Gwenaelle Toussaint, Philippe Stevens, Matthieu Becuwe, Alejandro A. Franco Batteries & Supercaps, 2022 Deconvoluting the Impacts of the Active Material Skeleton and the Inactive Phase Morphology on the Performance of Lithium Ion Battery Electrodes Mehdi Chouchane, Alejandro A.Franco Energy Storage Materials, 2022 The ARTISTIC Online Calculator: Exploring the Impact of Lithium-Ion Battery Electrode Manufacturing Parameters Interactively Through Your Browser Teo Lombardo, Fernando Caro, Alain C. Ngandjong, Jean-Baptiste Hoock, Marc Duquesnoy, Jean Charles Delepine, Adrien Ponchelet, Sylvain Doison, Prof. Dr. Alejandro A. Franco Batteries & Supercaps, 2022 Artificial neural network approach for multiphase segmentation of battery electrode nano-CT images Zeliang Su, Etienne Decencière, Tuan-Tu Nguyen, Kaoutar El-Amiry, Vincent De Andrade, Alejandro A. Franco, Arnaud Demortière npj computational materials, 2022 Deconvoluting benefits of porosity distribution in layered electrodes on electrochemical performance of Li-ion batteries Abbos Shodiev, Mehdi Chouchane, Miran Gaberscek, Oier Arcelus, Jiahui Xu, Hassan Oularbi, JiaYu, Jianlin Li, Mathieu Morcrette, Alejandro A.Franco Energy Storage Materials, 2022 Towards a Local In situ X-ray Nano Computed Tomography under Realistic Cycling Conditions for Battery Research Dr. Zeliang Su, Dr. Tuan-Tu Nguyen, Dr. Christophe Le Bourlot, Dr. François Cadiou, Dr. Arash Jamali, Dr. Vincent De Andrade, Prof. Alejandro A. Franco, Dr. Arnaud Demortière Chemistry Methods, 2022 A Roadmap for Transforming Research to Invent the Batteries of the Future Designed within the European Large Scale Research Initiative BATTERY 2030+ Julia Amici, Pietro Asinari, Elixabete Ayerbe, Philippe Barboux, Pascale Bayle-Guillemaud, R. Jürgen Behm, Maitane Berecibar, Erik Berg, Arghya Bhowmik, Silvia Bodoardo, Ivano E. Castelli, Isidora Cekic-Laskovic, Rune Christensen, Simon Clark, Ralf Diehm, Robert Dominko, Maximilian Fichtner, Alejandro A. Franco, Alexis Grimaud, Nicolas Guillet, Maria Hahlin, Sarah Hartmann, Vincent Heiries, Kersti Hermansson, Andreas Heuer, Saibal Jana, Lara Jabbour, Josef Kallo, Arnulf Latz, Henning Lorrmann, Ole Martin Løvvik, Sandrine Lyonnard, Marcel Meeus, Elie Paillard, Simon Perraud, Tobias Placke, Christian Punckt, Olivier Raccurt, Janna Ruhland, Edel Sheridan, Helge Stein, Jean-Marie Tarascon, Victor Trapp, Tejs Vegge, Marcel Weil, Wolfgang Wenzel, Martin Winter, Andreas Wolf, Kristina Edström Advanced Energy Materials, 2022 Perspectives on manufacturing simulations of Li-S battery cathodes Oier Arcelus and Alejandro A. Franco JPhys Energy, 2022 Towards autonomous high-throughput multiscale modelling of battery interfaces Zeyu Deng, Vipin Kumar, Felix T. Bölle, Fernando Caro, Alejandro A. Franco, Ivano E. Castelli, Pieremanuele Canepa, Zhi Wei Seh Energy and environmental science, 2022 Artificial Intelligence Applied to Battery Research: Hype or Reality ? Teo Lombardo, Marc Duquesnoy, Hassna El-Bouysidy, Fabian Årén, Alfonso Gallo-Bueno, Peter Bjørn Jørgensen, Arghya Bhowmik, Arnaud Demortière, Elixabete Ayerbe, Francisco Alcaide, Marine Reynaud, Javier Carrasco, Alexis Grimaud, Chao Zhang, Tejs Vegge, Patrik Johansson, and Alejandro A. Franco Chemical Reviews, 2021 Carbon-Binder Migration: A Three-Dimensional Evaporation Model for Lithium Ion Batteries Teo Lombardo, Alain C. Ngandjong, Amal Belhcen, Alejandro A. Franco Energy Storage Materials, 2021 Towards a 3D-resolved model of Si/Graphite composite electrodes from manufacturing simulations Chaoyue Liu, Oier Arcelus, Teo Lombardo, Hassan Oularbi, Alejandro A. Franco Journal of Power Sources, 2021 Machine learning 3D-resolved prediction of electrolyte infiltration in battery porous electrodes Abbos Shodiev, Marc Duquesnoy, Oier Arcelus, Mehdi Chouchane, Jianlin Li, Alejandro A. Franco Journal of Power Sources, 2021 Quantitatively Designing Porous Copper Current Collectors for Lithium Metal Anodes Bingyu Lu, Edgar Olivera, Jonathan Scharf, Mehdi Chouchane, Chengcheng Fang, Miguel Ceja, Lisa E. Pangilinan, Shiqi Zheng, Andrew Dawson, Diyi Cheng, Wurigumula Bao, Oier Arcelus, Alejandro A. Franco, Xiaochun Li, Sarah H. Tolbert, and Ying Shirley Meng ACS Applied Energy Materials, 2021 CHAMPION: Chalmers hierarchical atomic, molecular, polymeric and ionic analysis toolkit Rasmus Andersson, Fabian Årén, Alejandro A. Franco, Patrik Johansson Journal of Computational Chemistry, 2021 An Invitation to Engage with Computational Modeling: User-friendly Tool for In Silico Battery Component Generation and Meshing Mehdi Chouchane, Alejandro A. Franco Batteries & Supercaps, 2021 Machine Learning-Based on Assessment of the Impact of the Manufacturing Process on Battery Electrode Heterogeneity Marc Duquesnoy, Iker Boyano, Larraitz Ganborena, Pablo Cereijo, Elixabete Ayerbe, Alejandro A. Franco Energy and AI, 2021 Heterogeneous Solid Electrolyte Interphase in Graphite Electrodes Assessed by 4D‐Resolved Computational Simulations Mehdi Chouchane, Oier Arcelus, Alejandro A. Franco Batteries & Supercaps, 2021 Escape from flatland Alejandro A. Franco Nature Machine Intelligence, 2021 Fabrication of High-Quality Thin Solid-State Electrolyte Films Assisted by Machine Learning Yu-Ting Chen, Marc Duquesnoy, Darren H. S. Tan, Jean-Marie Doux, Hedi Yang, Grayson Deysher, Phillip Ridley, Alejandro A. Franco, Ying Shirley Meng, Zheng Chen ACS Energy Letters, 2021 How Machine Learning Will Revolutionize Electrochemical Sciences Aashutosh Mistry, Alejandro A. Franco, Samuel J. Cooper, Scott A. Roberts, Venkatasubramanian Viswanathan ACS Energy Letters, 2021 Insight on electrolyte infiltration of lithium ion battery electrodes by means of a new three-dimensional-resolved lattice Boltzmann model Abbos Shodiev, Emiliano Primo, Oier Arcelus Mehdi Chouchane, Markus Osenberg, André Hilger, Ingo Manke, Jianlin Li, Alejandro A.Franco Energy Storage Materials, 2021 Probing and Interpreting the Porosity and Tortuosity Evolution of Li-O2 Cathodes on Discharge through a Combined Experimental and Theoretical Approach Amangeldi Torayev, Simon Engelke, Zeliang Su, Lauren E. Marbella, Vincent De Andrade, Arnaud Demortière, Pieter C. M. M. Magusin, Céline Merlet, Alejandro A. Franco, Clare P. Grey The Journal of Physical Chemistry C, 2021 Calendering of Li(Ni0.33Mn0.33Co0.33)O2‐Based Cathodes: Analyzing the Link Between Process Parameters and Electrode Properties by Advanced Statistics Dr. Emiliano N. Primo, Dr. Matthieu Touzin, Prof. Dr. Alejandro A. Franco Batteries & Supercaps, 2021 Investigating electrode calendering and its impact on electrochemical performance by means of a new discrete element method model: Towards a digital twin of Li-Ion battery manufacturing Alain C. Ngandjong, Teo Lombardo, Emiliano Primo, Mehdi Chouchane, Abbos Shodiev, Oier Arcelus, Alejandro A. Franco Journal of Power Sources, 2021 What can text mining tell us about lithium‐ion battery researchers’ habits? Hassna El-Bousiydy, Teo Lombardo, Emiliano N. Primo, Marc Duquesnoy, Mathieu Morcrette, Patrik Johansson, Patrice Simon, Alexis Grimaud, Alejandro A. Franco Batteries & Supercaps, 2021 Understanding the calendering processability of Li(Ni0.33Mn0.33Co0.33)O2-based cathodes Emiliano N. Primo, Mehdi Chouchane, Matthieu Touzin, Patricia Vazquez, Alejandro A. Franco Journal of Power Sources, 2021 Ion Transport Mechanisms via Time-Dependent Local Structure and Dynamics in Highly Concentrated Electrolytes Rasmus Andersson, Fabian Årén, Alejandro A. Franco, Patrik Johansson Journal of The Electrochemical Society, 2020 Data-driven assessment of electrode calendering process by combining experimental results, in silico mesostructures generation and machine learning Marc Duquesnoy, Teo Lombardo, Mehdi Chouchane, Emiliano N. Primo, Alejandro A. Franco Journal of Power Sources, 2020 Understanding the reaction steps involving polysulfides in 1 M LiTFSI in TEGDME:DOL using cyclic voltammetry experiments and modelling Vigneshwaran Thangavel, Afef Mastouri, Claude Guéry, Mathieu Morcrette, Alejandro A. Franco Batteries & Supercaps, 2020 Entering the Augmented Era: Immersive and Interactive Virtual Reality for Battery Education and Research Alejandro A. Franco, Jean-Noël Chotard, Emilie Loup-Escande, Yinghui Yin, Ruijie Zhao, Alexis J. Rucci, Alain C. Ngandjong, Simon Herbulot, Benjamin Beye, Jan Ciger, Romain Lelong Batteries & Supercaps, 2020 Effects of a virtual reality game on learning performances and motivation: example of Nanoviewer in the field of energy storage Emilie Loup-Escande, Simon Herbulot, Alain Ngandjong, Romain Lelong, Guillaume Loup and Alejandro A. Franco Psychology and Education, 2020 X-ray Nanocomputed Tomography in Zernike Phase Contrast for Studying 3D Morphology of Li–O2 Battery Electrode Zeliang Su, Vincent De Andrade, Sorina Cretu, Yinghui Yin, Michael J. Wojcik, Alejandro A. Franco, and Arnaud Demortière ACS Applied Energy Materials, 2020 Accelerated Optimization Methods for Force‐Field Parametrization in Battery Electrode Manufacturing Modeling Teo Lombardo, Dr. Jean‐Baptiste Hoock, Dr. Emiliano N. Primo, Dr. Alain C. Ngandjong, Marc Duquesnoy, Prof. Dr. Alejandro A. Franco Batteries & Supercaps, 2020 Mesoscale Effects in the Extraction of the Solid-State Lithium Diffusion Coefficient Values of Battery Active Materials: Physical Insights from 3D Modeling Mehdi Chouchane, Emiliano N. Primo, and Alejandro A. Franco The Journal of Physical Chemistry Letters, 2020 4D-resolved physical model for Electrochemical Impedance Spectroscopy of Li(Ni1-x-yMnxCoy)O2-based cathodes in symmetric cells: Consequences in tortuosity calculations Abbos Shodiev, Emiliano N. Primo, Mehdi Chouchane, Teo Lombardo, Alain C. Ngandjong, Alexis Rucci, Alejandro A. Franco Journal of Power Sources, 2020 A three dimensional kinetic Monte Carlo model for simulating the carbon/sulfur mesostructural evolutions of discharging lithium sulfur batteries Vigneshwaran Thangavel, Oscar Xavier Guerrero, Matias Quiroga, Adelphe Matsiegui Mikala, Alexis Rucci, Alejandro A. Franco Energy Storage Materials, 2020 Cover Feature: Artificial Intelligence Investigation of NMC Cathode Manufacturing Parameters Interdependencies (Batteries & Supercaps 1/2020) Ricardo Pinto Cunha, Teo Lombardo, Dr. Emiliano N. Primo, Prof. Dr. Alejandro A. Franco Batteries & Supercaps, 2020 Mechanistic Elucidation of Si Particle Morphology on Electrode Performance Ankit Verma, Alejandro A. Franco, Partha P. Mukherjee Journal of The Electrochemical Society, 2019 Artificial Intelligence Investigation of NMC Cathode Manufacturing Parameters Interdependencies Ricardo Pinto-Cunha, Teo Lombardo, Emiliano Primo, Alejandro A. Franco Batteries & Supercaps, 2019 Lithium ion battery electrodes predicted from manufacturing simulations: Assessing the impact of the carbon-binder spatial location on the electrochemical performance Mehdi Chouchane, Alexis Rucci, Teo Lombardo, Alain C. Ngandjong, Alejandro A. Franco Journal of Power Sources, 2019 Text mining assisted review of the literature on Li-O2 batteries Amangeldi Torayev, Pieter Magusin, Clare Grey, Celine Merlet, Alejandro A. Franco JPhys Materials, 2019 Tracking variabilities in the simulation of Lithium Ion Battery electrode fabrication and its impact on electrochemical performance Alexis Rucci, Alain C. Ngandjong, Emiliano N. Primo, Mariem Maiza, Alejandro A. Franco Electrochimica Acta, 2019 A three dimensional kinetic Monte Carlo model for simulating the carbon/sulfur mesostructural evolutions of discharging Lithium sulfur batteries Vigneshwaran Thangavel, Oscar Xavier Guerrero, Matias Quiroga, Adelphe Matsiegui Mikala, Alexis Rucci, Alejandro A.Franco Energy Storage Materials, 2019 A Versatile and Efficient Voxelization-Based Meshing Algorithm of Multiple Phases Mehdi Chouchane, Alexis Rucci, Alejandro A. Franco ACS Omega, 2019 Interphases in Electroactive Suspension Systems: where Chemistry meets Mesoscale Physics Garima Shukla, Alejandro Franco Batteries & Supercaps, 2019 Evaluating the impact of transport inertia on the electrochemical response of lithium ion battery single particle models Mariem Maiza, Youcef Mammeri, Dinh An Nguyen, Nathalie Legrand, Philippe Desprez, Alejandro A.Franco Journal of Power Sources, 2019 Boosting Rechargeable Batteries R&D by Multiscale Modeling: Myth or Reality? Alejandro A. Franco, Alexis Rucci, Daniel Brandell, Christine Frayret, Miran Gaberscek, Piotr Jankowski, Patrik Johansson Chemical Reviews, 2019 On the Importance of Incorporating Explicit 3D-Resolved Electrode Mesostructures in Li-O2 Models Amangeldi Torayev, Pieter C. M. M. Magusin, Clare P. Grey, Céline Merlet, Alejandro A. Franco Applied Energy Materials, 2018 Unraveling the operation mechanisms of Lithium Sulfur Batteries with ultramicroporous carbons Yinghui Yin, Alejandro A. Franco Applied Energy Materials, 2018 Handling Complexity of Semi-solid Redox Flow Battery Operation Principles Through Mechanistic Simulations Garima Shukla, Alejandro A. Franco The Journal of Physical Chemistry C, 2018 Investigation of bi-porous electrodes for lithium oxygen batteries Caroline Gaya, Yinghui Yin, Amangeldi Torayev, Youcef Mammeri, Alejandro A. Franco Electrochimica Acta, 2018 Stochasticity of Pores Interconnectivity in Li-O2 Batteries and Its Impact on the Variations in Electrochemical Performance Amangeldi Torayev, José Alexis Rucci, Pieter M. Magusin, Arnaud Demortière, Vincent De Andrade, Clare P. Grey, Céline Merlet, Alejandro A. Franco The Journal of Physical Chemistry Letters, 2018 Multiscale Simulation Platform Linking Lithium Ion Battery Electrode Fabrication Process with Performance at the Cell Level Alain Ngandjong, Alexis Rucci, Mariem Maiza, Garima Shukla, Jorge Gabriel Vazquez-Arenas, and Alejandro A. Franco The Journal of Physical Chemistry Letters, 2017 Linking the Performances of Li–O2 Batteries to Discharge Rate and Electrode and Electrolyte Properties through the Nucleation Mechanism of Li2O2 Yinghui Yin, Amangeldi Torayev, Caroline Gaya, Youcef Mammeri, Alejandro A. Franco The Journal of Physical Chemistry C, 2017 Self-organization of Electroactive Suspensions in Discharging Slurry Batteries: A Mesoscale Modeling Investigation Garima Shukla, Diego Del Olmo Diaz, Vigneshwaran Thangavel, Alejandro A. Franco Applied Materials and Interfaces, 2017 Boundary control of the number of interfaces for the one-dimensional Allen-Cahn equation Jean-Paul Chehab, Alejandro A. Franco, Youcef Mammeri Discrete and Continuous Dynamical Systems - Series S, 2017 Compactness of the Lithium Peroxide Thin Film Formed in Li-O2 Batteries and Its Link to Charge Transport Mechanism: Insights from Stochastic Simulations Yinghui Yin, Ruijie Zhao, Yue Deng, and Alejandro A. Franco The Journal of Physical Chemistry Letters, 2017 A Microstructurally Resolved Model for Li-S Batteries Assessing the Impact of the Cathode Design on the Discharge Performance Vigneshwaran Thangavel, Kan-Hao Xue, Youcef Mammeri, Matias Quiroga, Afef Mastouri, Claude Guéry, Patrik Johansson, Mathieu Morcrette, Alejandro A. Franco Journal of The Electrochemical Society, 2016 Impact of Li2O2 Particle Size on Li-O2 Battery Charge Process: Insights from a Multi-Scale Modeling Perspective Yinghui Yin, Caroline Gaya, Amangeldi Torayev, Vigneshwaran Thangavel, and Alejandro A. Franco The Journal of Physical Chemistry Letters, 2016 A multi-scale model of the oxygen reduction reaction on highly active graphene nanosheets in alkaline conditions. J. Vazquez-Arenas, G. Ramos-Sanchez, A. A. Franco Journal of Power Sources, 2016 How Does the Surface Structure of Pt-Ni Alloys Control Water and Hydrogen Peroxide Formation? R. Ferreira de Morais, AA. Franco, P. Sautet, D. Loffreda ACS Catalysis, 2016 Performance and degradation of Proton Exchange Membrane Fuel Cells: State of the art in modeling from atomistic to system scale T. Jahnke, G. Futter, A. Latz, T. Malkow, G. Papakonstantinou, G. Tsotridis, P. Schott, M. Gérard, M. Quinaud, M. Quiroga, AA. Franco, K. Malek, F. Calle-Vallejo, R. Ferreira de Morais, T. Kerber, P. Sautet, D. Loffreda, S. Strahl, M. Serra, P. Polverino, C. Pianese, M. Mayur, W.G. Bessler, C. Kompis Journal of Power Sources, 2016 Structural and Surface Coverage Effects on CO Oxidation Reaction over Carbon-Supported Pt Nanoparticles studied by Quadrupole Mass Spectrometry and Diffuse Reflectance FTIR Spectroscopy S. K. Cheah, V. Perrot-Bernardet, A. A. Franco, O. Lemaire, P. Gelin Physical Chemistry Chemical Physics, 2016 Modeling Investigation of the Local Electrochemistry in Lithium-O2 Batteries: A Kinetic Monte Carlo Approach G. Blanquer, Y. Yin, M. A. Quiroga, A. A. Franco Journal of The Electrochemical Society, 2016 A Drift-Diffusion Study on Charge Unbalancing Effects in Dye-Sensitized Solar Cells D. Gentilini, A. Gagliardi, AA. Franco, F. Sauvage, A. di Carlo Journal of The Electrochemical Society, 2015 Morphology of Supported Polymer Electrolyte Ultrathin Films: A Numerical Study DD. Borges, G. Gebel, AA. Franco, K. Malek, S. Mossa Journal of Materials Chemistry C, 2015 A Multi-Paradigm Computational Model of Materials Electrochemical Reactivity for Energy Conversion and Storage MA. Quiroga, AA. Franco Journal of The Electrochemical Society, 2015 Coverage-dependent thermodynamic analysis of the formation of water and hydrogen peroxide on a platinum model catalyst R. Ferreira de Morais, AA. Franco, P. Sautet, D. Loffreda Physical Chemistry Chemical Physics, 2015 Interplay between Reaction Mechanism and Hydroxyl Species for Water Formation on Pt(111) R. Ferreira de Morais, AA. Franco, P. Sautet, D. Loffreda ACS Catalysis, 2015 A comprehensive model for non-aqueous lithium air batteries involving different reaction mechanisms KH. Xue, E. McTurk, L. Johnson, P. G. Bruce, AA. Franco Journal of The Electrochemical Society, 2015 Electrode structure effects on the performance of open-cathode proton exchange membrane fuel cells: A multiscale modeling approach S. Strahl, A. Husar, AA. Franco International Journal of Hydrogen Energy, 2014 Electrodeposition of TiO2 Using Ionic Liquids S. Patra, S. Bruyère, P-L. Taberna, F. Sauvage ECS Electrochemistry Letters, 2014 A Multiscale Model of Electrochemical Double Layers in Energy Conversion and Storage Devices K.-H. Xue, T.-K. Nguyen, M. Tulodziecki, H. Huang, AA. Franco Journal of The Electrochemical Society, 2014 Impact of the Cathode Microstructure on the Discharge Performance of Lithium Air Batteries: A Multiscale Model KH. Xue, TK. Nguyen, AA. Franco Journal of The Electrochemical Society, 2014 A multiscale physical model of a polymer electrolyte membrane water electrolyzer L. F. L. Oliveira, C. Jallut, A.A. Franco Electrochimica Acta, 2013 Multiscale modelling and numerical simulation of rechargeable lithium ion batteries: concepts, methods and challenges AA. Franco RSC Advances, 2013