Expertise in Quantum and Computational Chemistry applied to nanotechnological and supramolecular issues, focusing on physico-chemical properties influencing the performance of materials and devices. This expertise complements synergically with: (i) the development of more accurate and robust theoretical methods for computations at the nanoscale; and (ii) the advanced mentoring and tutoring of graduate students and young researchers. We have worked in close connection with high-tech research hubs, and with national and international funding agencies.