Mark A. Boyer

Beyond Badger’s Rule: The Origins and Generality of the Structure–Spectra Relationship of Aqueous Hydrogen Bonds

Mark A. Boyer, Ondřej Maršálek, Joseph P. Heindel et al. · The Journal of Physical Chemistry Letters · 2019 · 75 citations · Full text

A flexible approach to vibrational perturbation theory using sparse matrix methods

Mark A. Boyer, Anne B. McCoy · The Journal of Chemical Physics · 2022 · 26 citations

Fast Near <i>Ab Initio</i> Potential Energy Surfaces Using Machine Learning

Fenris Lu, Lixue Cheng, Ryan J. DiRisio et al. · The Journal of Physical Chemistry A · 2022 · 22 citations

A wave function correction-based approach to the identification of resonances for vibrational perturbation theory

Mark A. Boyer, Anne B. McCoy · The Journal of Chemical Physics · 2022 · 21 citations

Infrared spectroscopic signature of a hydroperoxyalkyl radical (•QOOH)

Anne S. Hansen, Trisha Bhagde, Yujie Qian et al. · The Journal of Chemical Physics · 2021 · 18 citations · Full text