Kurt Brorsen

Maxim Secor


Modeling of multi-proton coupled electron transfer and investigation of nuclear quantum effects at interfaces

maxim.secor@yale.edu

B.A./M.A. in Chemistry, 2015
Boston University, Boston, MA

Publications

Artificial neural networks as mappings between proton potentials, wave functions, densities, and energy levels

299. M. Secor, A. V. Soudackov, and S. Hammes-Schiffer, “Artificial neural networks as mappings between proton potentials, wave functions, densities, and energy levels,” J. Phys. Chem. Lett. 12, 2206-2212 (2021).

The role of intact hydrogen-bond networks in multiproton-coupled electron transfer

294. W. D. Guerra, E. Odella, M. Secor, J. J. Goings, M. N. Urrutia, B. L. Wadsworth, M. Gervaldo, L. E. Sereno, T. A. Moore, G. F. Moore, S. Hammes-Schiffer, and A. L. Moore, “The role of intact hydrogen-bond networks in multiproton-coupled electron transfer,” J. Am. Chem. Soc. 142, 21842-21851 (2020).

Inhomogeneity of interfacial electric fields at vibrational probes on electrode surfaces

272. Z. K. Goldsmith, M. Secor, and S. Hammes-Schiffer, “Inhomogeneity of interfacial electric fields at vibrational probes on electrode surfaces,” ACS Cent. Sci. 6, 304-311 (2020).