Electrochemical Solvent Reorganization Energies in the Framework of the Polarizable Continuum Model

Journal Article · Tue May 13 00:00:00 EDT 2014 · Journal of Chemical Theory and Computation

DOI:https://doi.org/10.1021/ct500051e· OSTI ID:1161386

Ghosh, Soumya; Horvath, Samantha; Soudackov, Alexander V; Hammes-Schiffer, Sharon

• Research Organization: Energy Frontier Research Centers (EFRC) (United States). Center for Molecular Electrocatalysis (CME)
• Sponsoring Organization: USDOE Office of Science (SC), Basic Energy Sciences (BES)
• DOE Contract Number: AC05-76RL01830
• OSTI ID: 1161386
• Journal Information: Journal of Chemical Theory and Computation, Vol. 10; Related Information: CME partners with Pacific Northwest National Laboratory (lead); University of Illinois, Urbana-Champaign; Pennsylvania State University; University of Washington; University of Wyoming
• Country of Publication: United States
• Language: English

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