Mechanistic analysis of electron transfer kinetics:
thermal and photoinitiated; intra- and intermolecular; homogeneous and
interfacial.
Calculation of nonequilibrium solvation thermodynamics for electron
transfer ( free energies and entropies) using quantum chemical techniques,
molecular-level force fields, and dielectric continuum models.
Formulation
of compact electronic state spaces for modeling electron transfer, using
optical spectroscopic data
Telephone #: (631) 344-4366
newton@bnl.gov