Nanoelectronics – theory and simulation
Research topics
- Theory and simulation of electronic transport properties of
nanoscale systems,
- Electronic structure and applications of Density Functional Theory,
- Quantum transport and nonequilibrium Green's functions (NEGF),
- First-principles modeling of current-induced phenomena,
electron-phonon coupling, inelastic scattering, and local heating,
- Nanoelectronics/molecular electronics,
- Fullerenes and carbon nanostructures,
- Reaction dynamics and adsorbates on surfaces,
- Physical and chemical properties of open-shell nanographenes.
