Theoretical modeling of electrochemical proton-coupled electron transfer

323. R. E. Warburton, A. V. Soudackov, and S. Hammes-Schiffer, “Theoretical modeling of electrochemical proton-coupled electron transfer,” Chem. Rev. (ASAP). DOI: 10.1021/acs.chemrev.1c00929

Understanding hydrogen atom and hydride transfer processes during electrochemical alcohol and aldehyde oxidation

317. M. T. Bender, R. Warburton, S. Hammes-Schiffer, and K.-S. Choi, “Understanding hydrogen atom and hydride transfer processes during electrochemical alcohol and aldehyde oxidation,” ACS Catal. 11, 15110-15124 (2021).DOI: 10.1021/acscatal.1c04163

Multicapacitor approach to interfacial proton-coupled electron transfer thermodynamics at constant potential

311. P. Hutchison, R. E. Warburton, A. V. Soudackov, and S. Hammes-Schiffer, “Multicapacitor approach to interfacial proton-coupled electron transfer thermodynamics at constant potential,” J. Phys. Chem. C 125, 21891-21901 (2021). DOI: 10.1021/acs.jpcc.1c04464

Proton-coupled defects impact O—H bond dissociation free energies on metal oxide surfaces

310. R. E. Warburton, J. M. Mayer, and S. Hammes-Schiffer, “Proton-coupled defects impact O—H bond dissociation free energies on metal oxide surfaces,” J. Phys. Chem. Lett. 12, 9761-9767 (2021). DOI: 10.1021/acs.jpclett.1c02837

Mechanistic insights about electrochemical proton-coupled electron transfer derived from a vibrational probe

305. S. Sarkar, A. Maitra, W. R. Lake, R. E. Warburton, S. Hammes-Schiffer, and J. M. Dawlaty, “Mechanistic insights about electrochemical proton-coupled electron transfer derived from a vibrational probe,” J. Am. Chem. Soc. 143, 8381-8390 (2021).

Interfacial field-driven proton-coupled electron transfer at graphite-conjugated organic acids

289. R. E. Warburton, P. Hutchison, M. N. Jackson, M. L. Pegis, Y. Surendranath, and S. Hammes-Schiffer, “Interfacial field-driven proton-coupled electron transfer at graphite-conjugated organic acids,” J. Am. Chem. Soc. 142, 20855-20864 (2020).