Event Information
Kieron Burke
(Rutgers University)
Time-Dependent Density Functional Theory in Chemistry: Successes and Challenges
Departmental Seminar
Time-Dependent Density Functional Theory in Chemistry: Successes and Challenges
- Abstract:
- Ground-state density functional theory has had an enormous impact in
chemistry, and the time-dependent theory holds similar promise. I will
explain how time-dependent density functional theory works, and discuss
calculations of electronic excitations in molecules, electron-molecule
scattering, and molecular electronics. I will avoid mathematical formalism.
Host: Weitao Yang
Departmental Seminar