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The Journal of Chemical Physics|December 29, 2010
Communication: Hybrid ensembles for improved force matchingLee-Ping Wang, Troy Van VoorhisJournal of Chemical Theory and Computation|November 25, 2015
A Polarizable QM/MM Explicit Solvent Model for Computational Electrochemistry in WaterLee-Ping Wang, Troy Van VoorhisInorganic Chemistry|April 17, 2010
Acid-base mechanism for ruthenium water oxidation catalystsLee-Ping Wang, Qin Wu, Troy Van VoorhisJournal of Chemical Theory and Computation|November 22, 2015
Systematic Parametrization of Polarizable Force Fields from Quantum Chemistry DataLee-Ping Wang, Jiahao Chen, Troy Van VoorhisThe Journal of Physical Chemistry. B|October 4, 2011
Simulation of solution phase electron transfer in a compact donor-acceptor dyadTim Kowalczyk, Lee-Ping Wang, Troy Van VoorhisJournal of Computational Chemistry|March 14, 2015
Why many semiempirical molecular orbital theories fail for liquid water and how to fix themMatthew Welborn, Jiahao Chen, Lee-Ping Wang, et al.Accounts of Chemical Research|May 7, 2010
Electronic properties of disordered organic semiconductors via QM/MM simulationsSeth Difley, Lee-Ping Wang, Sina Yeganeh, et al.Annual Review of Physical Chemistry|January 9, 2010
The diabatic picture of electron transfer, reaction barriers, and molecular dynamicsTroy Van Voorhis, Tim Kowalczyk, Benjamin Kaduk, et al.Inorganic Chemistry|April 4, 2014
What can density functional theory tell us about artificial catalytic water splitting?Michael G Mavros, Takashi Tsuchimochi, Tim Kowalczyk, et al.Physical Chemistry Chemical Physics : PCCP|November 6, 2009
The influence of initial conditions on charge transfer dynamicsHenk Eshuis, Troy van VoorhisPageof 22