Chemical and materials theorist (in training).
I am currently a final year undergrad at Universidad Nacional Autónoma de México (UNAM), and will soon be a Ph.D. student at UC San Diego.
There, I will be work with theory and simulations to understand the dynamics of moleuclar and solid-state materials.
I am interested in quantum inorganic and hybrid organic/inorganic materials, Density Functional Theory DFT, Tight-Binding models TB, and quantum Molecular Dynamics MD. My experience really resides in TB and DFT. My go-to code is Quantum ESPRESSO. I have also used Wien2K and VASP.
Currently, I work on Data-driven materials discovery, and on the prediction of new magnetic two-dimensional materials. Particularly, I am interested in the diverse class of transition metal chalcogenides.
I don't have an extensive publications list yet... but I'll get there.