Using computational chemistry to design pump–probe schemes for measuring nitrobenzene radical cation dynamics
Abstract
Computed potential energy surfaces of the nitrobenzene cation predict suitable excitation conditions for enhancing ion yield oscillations in time-resolved measurements.
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 01, 2021
- Source ID
- 10.1039/d1cp00360g
Entities
People
- Derrick Ampadu Boateng
- Hugo A. López Peña
- Katharine Moore Tibbetts
- Shane L. Mcpherson
Organizations
- Army Research Office
- United States Army
- Virginia Commonwealth University
- Yusuf Hamied Department of Chemistry