Ryan P. Steele

Advances in molecular quantum chemistry contained in the Q-Chem 4 program package

Yihan Shao, Zhengting Gan, Evgeny Epifanovsky et al. · Molecular Physics · 2014 · 3.1K citations

Program Package, Engineering, Theoretical Inorganic Chemistry +22

Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package

Evgeny Epifanovsky, Andrew T. B. Gilbert, Xintian Feng et al. · The Journal of Chemical Physics · 2021 · 1.3K citations · Full text

An improved algorithm for analytical gradient evaluation in resolution‐of‐the‐identity second‐order Møller‐Plesset perturbation theory: Application to alanine tetrapeptide conformational analysis

Robert A. DiStasio, Ryan P. Steele, Young Min Rhee et al. · Journal of Computational Chemistry · 2007 · 148 citations

Potential Energy Curves for Cation−π Interactions: Off-Axis Configurations Are Also Attractive

Michael S. Marshall, Ryan P. Steele, K. Sahan Thanthiriwatte et al. · The Journal of Physical Chemistry A · 2009 · 147 citations

The initial and final states of electron and energy transfer processes: Diabatization as motivated by system-solvent interactions

Joseph E. Subotnik, Robert J. Cave, Ryan P. Steele et al. · The Journal of Chemical Physics · 2009 · 146 citations

Localized Excited State, Engineering, Boys Localization +18