Instituto de Nanociencia y Materiales de Aragón (INMA) | Spanish National Research Council
Understanding why matter behaves the way it does and designing the materials we need.
We combine first-principles calculations, molecular dynamics, and machine learning to discover and understand functional materials.
SrTiO3 perovskite Cubic ABO3 structure.
Superconductors and emergent quantum phases.
Ferroelectric, ferromagnetic, and multiferroic materials for electronics and spintronics devices.
Thermoelectrics, catalysis, and energy storage materials.
Electronic-structure theory, lattice dynamics, and molecular dynamics across length scales.
Data-driven models for materials discovery, prediction, and optimization.
Close links between simulations, measurements, and interpretable materials design.
We develop computational approaches to understand and design functional materials, bridging quantum mechanics, atomistic simulations, and data-driven methods.
We sincerely acknowledge the generous financial and computational support of our present and past sponsors.
