Research

Formalism

  • Orbital-dependent density functionals
  • Optimally-tuned range-separated hybrid functionals
  • Ensemble-generalized functionals
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Properties of Materials

  • Biogenic and bio-inspired materials
  • Halide Perovskites
  • Two-dimensional materials
  • Molecular Spintronics
  • Porphyrins and phthalocyanines
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Computational Methodology

  • Adventures in (Real) Space
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