Chemistry & Biochemistry
2. Coherence effects, order, and defects in materials • 5. Chemical processes-dependent on nano- and meso-scale dimensions • 6. Integration of length scales in materials • 10. Optoelectronic properties • 11. Nanoscale self-assembly and fabrication • 12. Theory and simulation of phenomena
General Area(s) of Research: Theory and computation
Description of potential projects for CINEMA applicants: Singlet fission calculations for molecular aggregates and crystals, interfacing model Hamiltonians to microscopic electronic structure. Electronic structure of functionalized graphene sheets for water desalination and dynamics of water passage through these sheets. Phase transitions in glassy and non-glassy active matter systems.