Martin P. Head-Gordon Chemistry theoretical chemistry, electronic structure calculations, development of novel theories and algorithms, quantum mechanics
Teresa Head-Gordon Bioengineering Chemical & Biomolecular Engineering Chemistry Computational chemistry, biophysics, bioengineering, biomolecules, materials, catalysis, computational science
William H. Miller Chemistry theoretical chemistry, chemical dynamics, quantum mechanical and semiclassical theories, dynamical chemical processes at the molecular level, photodissociation, femtosecond pump-probe spectroscopy, calculations of rate constants for chemical reactions