Abstract
Quantum dynamics of photoionization from Cl 2 - is investigated by constructing a purely one-electron model Hamiltonian of the anion calibrated with the help of ab initio theoretical calculations at the MRSD-CI level. A mean-field time-dependent Fourier grid Hamiltonian method is used to investigate the modulation of the dynamics of photoionization from Cl 2 - caused by the coupling of electronic and nuclear motions. Vibrational quenching at low coupling strength is predicted to turn into vibrational enhancement of ionization at higher strengths of coupling.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callDisclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
