Calculations of Mode-Specific Tunneling of Double-Hydrogen Transfer in Porphycene Agree with and Illuminate Experiment
Author:
Affiliation:
1. Cherry L. Emerson Center for Scientific Computation and Department of Chemistry, Emory University, Atlanta, Georgia 30322, United States
Funder
Army Research Office
Publisher
American Chemical Society (ACS)
Subject
General Materials Science,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jz501482v
Reference38 articles.
1. Vibrational tuning of the Hydrogen transfer in malonaldehyde – a combined FTIR and Raman jet study†
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3. Electronic spectra of jet‐cooled tropolone. Effect of the vibrational excitation on the proton tunneling dynamics
4. Vibrational mode-specific tunneling splittings in the A states of deuterated tropolones
5. Dynamics of double-proton-transfer reaction in the excited-state model hydrogen-bonded base pairs
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