Profesor Agregado
Department of Physics, UPV/EHU
Molecular Simulation Materials & Interfaces
Postdoctoral Researcher
Department of Physical Chemistry, UPV/EHU
Molecular Simulation of CSH & Geopolymers
Profesor laboral interino
Department of Physics, UPV/EHU
Machine Learning techniques for Atomic-scale simulations
PhD student
Department of Physics, UPV/EHU
Molecular modeling of novel electrolytes for efficient Li-ion batteries
Profesor Ayudante Doctor
Department of Physics, UPV/EHU
Cement Science, experiments and simulations
PhD student
Department of Physics, UPV/EHU
Atomistic Simulation of CaCO3 nucleation and growth
Yerai Folio, researcher. Modifications of pyCSH code
Brigette Fortuin, PhD student CIC Energigune (advisor: María Martínez) Synthesis, characterization and modeling of solid state electrolites
Aleena Alex MSCA-ADAGIO post doctoral research fellow Molecular Dynamics and Kinetic Monte Carlo modelling of CaCO3 cements
Pablo Martin, Ph.D. student + Postdoctoral researcher, UPV/EHU and Tecnalia. Kinetic Monte Carlo: development & application to dissolution
Xabier Mendez Aretxabaleta, Ph.D. student and Professor at UPV/EHU, Calcium Silicate Hydrate nucleation
Qianqian Wang Ph.D. student, NanjingTech. Molecular & Quantum Simulation of Material hydration and dissolution
Sergio Rodriguez Peña, PhD student, CIC Energigune, Molecular modeling of novel electrolytes for efficient Li-ion batteries
Umar Hayat, Ph.D. student, The Hong Kong Polytechnic University. Molecular Dynamics of sea water C-S-H interfaces
Jiale Huang, Ph.D. student, SouthEast University, Nanjing. Atomistic Simulation of Temperature Rise Inhibitors (TRI)
Qi Zhai, Ph.D. student, Hokkaido University. Impact of TEA on OPC hydration | Reactivity of slags
Mina Gahne, Ph.D. student, Oulu University, Finland. Atomistic simulation of hydrated Mg-carbonate cements (2023)
Annet Baken, Ph.D. student, ISTERRE, Grenoble. Modeling Portlandite nucleation and growth (2023)
Group members at the ICCC23 in Bangkok
Group picture 2022
Group picture 2015
Group picture 2018