Work

Regarding the validity of the time-dependent Kohn–Sham approach for electron-nuclear dynamics via trajectory surface hopping

Year: 2011

Type: article

Source: The Journal of Chemical Physics

DOI: 10.1063/1.3526297

Authors: Sean A. Fischer, Bradley F. Habenicht, Angeline B. Madrid, Walter R. Duncan, Oleg V. Prezhdo

Institutions: University of Washington, University of Rochester, University of Tennessee at Knoxville, Schrodinger (United States)

Language: English

Topic: Spectroscopy and Quantum Chemical Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: closed

Funders: National Science Foundation, U.S. Department of Energy, Division of Chemistry

Awards: Time-domain ab initio studies of excitation dynamics in nanoscale materials, ATOMISTIC REAL-TIME SIMULATION OF LIGHT HARVESTING AND CHARGE TRANSFER DYNAMICS IN NOVEL NANOSCALE M

OpenAlex ID: W1964678249

FWCI: 5.668

Cites: 57

Cited by: 221

Related to: 10