Theory of electrochemical proton-coupled electron transfer in diabatic vibronic representation: Application to proton discharge on metal electrodes in alkaline solution

290. Y.-C. Lam, A. V. Soudackov, and S. Hammes-Schiffer, “Theory of electrochemical proton-coupled electron transfer in diabatic vibronic representation: Application to proton discharge on metal electrodes in alkaline solution,” J. Phys. Chem. C 124, 27309-27322 (2020).

Strategies for enhancing the rate constant of C—H bond cleavage by concerted proton-coupled electron transfer

263. E. Sayfutyarova, Y. C. Lam, and S. Hammes-Schiffer, “Strategies for enhancing the rate constant of C—H bond cleavage by concerted proton-coupled electron transfer,” J. Am. Chem. Soc. 141, 15183-15189 (2019).

Kinetics of proton discharge on metal electrodes: Effects of vibrational nonadiabaticity and solvent dynamics

260. Y. C. Lam, A. V. Soudackov, and S. Hammes-Schiffer, “Kinetics of proton discharge on metal electrodes: Effects of vibrational nonadiabaticity and solvent dynamics,” J. Phys. Chem. Lett. 10, 5312-5217 (2019).

Theory of proton discharge on metal electrodes: Electronically adiabatic model

254. Y.-C. Lam, A. V. Soudackov, Z. K. Goldsmith, and S. Hammes-Schiffer, “Theory of proton discharge on metal electrodes: Electronically adiabatic model,” J. Phys. Chem.123, 12335-12345 (2019).

Proton discharge on a gold electrode from triethylammonium in acetonitrile: Theoretical modeling of potential-dependent kinetic isotope effects

248.  Z. K. Goldsmith, Y. C. Lam, A V. Soudackov, and S. Hammes-Schiffer, “Proton discharge on a gold electrode from triethylammonium in acetonitrile: Theoretical modeling of potential-dependent kinetic isotope effects,” J. Am. Chem. Soc. 141, 1084-1090 (2019).