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Physical Chemistry Chemical Physics : PCCP|January 5, 2026
Spin transport in the phenalenyl radical throughout molecular dynamics trajectoriesKevin Batzinger, Manuel SmeuPhysical Chemistry Chemical Physics : PCCP|November 30, 2022
Electron passivation in CaF<sub>2</sub> on calcium metal anodesKevin Batzinger, Manuel SmeuPhysical Chemistry Chemical Physics : PCCP|January 23, 2024
A computational study of electron transport in dynamic tetrahydrofuran and ethylene carbonate solvents on a Ca metal anodeKevin Batzinger, Diana Liepinya, Manuel SmeuAngewandte Chemie (International Ed. in English)|July 2, 2026
Fundamentals, Measurement and Regulation of the Conductance of Single Molecule JunctionsParisa Yasini, Kevin Batzinger, Manuel Smeu, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|April 17, 2024
Steric Effects on Single-Molecule Conductance in Flat-Lying PhenanthreneKevin Batzinger, Qinghai Zhou, Xiang Ye, et al.The Journal of Physical Chemistry Letters|June 2, 2018
Ethylene Carbonate-Based Electrolyte Decomposition and Solid-Electrolyte Interphase Formation on Ca Metal AnodesJoshua Young, Manuel SmeuThe Journal of Chemical Physics|April 22, 2019
First principles study of graphene on metals with the SCAN and SCAN+rVV10 functionalsStuart Shepard, Manuel SmeuJournal of Physics. Condensed Matter : an Institute of Physics Journal|January 18, 2024
Voltage prediction of vanadium redox flow batteries from first principlesScott Brennan, Manuel SmeuPhysical Chemistry Chemical Physics : PCCP|February 3, 2021
Electron leakage through heterogeneous LiF on lithium-metal battery anodesManuel Smeu, Kevin LeungThe Journal of Organic Chemistry|May 10, 2007
Rearrangement of the 1,1-diphenylethoxyl radical is not concerted but occurs through a bridged intermediateManuel Smeu, Gino A DiLabioPageof 4