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All papers authored by Joseph Gauthier

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2022 Sudarshan Vijay

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, Georg Kastlunger

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, Joseph A. Gauthier

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Force-Based Method to Determine the Potential Dependence in Electrochemical Barriers

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Hendrik H. Heenen

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, Georg Kastlunger

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, Joseph A. Gauthier

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The mechanism for acetate formation in electrochemical CO₍₂₎reduction on Cu: selectivity with potential, pH, and nanostructuring

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2021 Christianna N. Lininger

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, Joseph A. Gauthier

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, Wan-Lu Li, Elliot Rossomme

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, Valerie Vaissier Welborn, Zhou Lin, Teresa Head-Gordon

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, Martin Head-Gordon

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, Alexis T. Bell

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Challenges for density functional theory: calculation of CO adsorption on electrocatalytically relevant metals

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2020 Sudarshan Vijay

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, Joseph A. Gauthier

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, Hendrik H. Heenen

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, Vanessa J. Bukas

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, Henrik H. Kristoffersen

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Dipole-Field Interactions Determine the CO2 Reduction Activity of 2D Fe–N–C Single-Atom Catalysts

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Joseph A. Gauthier

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, Leanne D. Chen

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, Michal Bajdich

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Implications of the fractional charge of hydroxide at the electrochemical interface

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2019 Joseph A. Gauthier

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, Meredith Fields, Michal Bajdich

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, Leanne D. Chen

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, Robert B. Sandberg, Karen Chan

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, Jens K. Nørskov

Facile Electron Transfer to CO2 during Adsorption at the Metal|Solution Interface

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Joseph A. Gauthier

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, Colin F. Dickens

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, Hendrik H. Heenen

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, Sudarshan Vijay, Stefan Ringe

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Unified Approach to Implicit and Explicit Solvent Simulations of Electrochemical Reaction Energetics

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Thomas Ludwig

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, Joseph A. Gauthier

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, Kristopher S. Brown, Stefan Ringe

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, Jens K. Nørskov, Karen Chan

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Solvent–Adsorbate Interactions and Adsorbate-Specific Solvent Structure in Carbon Dioxide Reduction on a Stepped Cu Surface

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2018 Joseph A. Gauthier

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, Colin F. Dickens

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, Alejandro J. Garza, Alexis T. Bell

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, Martin Head-Gordon

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, Jens K. Nørskov, Karen Chan

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Challenges in Modeling Electrochemical Reaction Energetics with Polarizable Continuum Models

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2017 Joseph A. Gauthier

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, Colin F. Dickens

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, Leanne D. Chen

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, Andrew D. Doyle, Jens K. Nørskov

Solvation Effects for Oxygen Evolution Reaction Catalysis on IrO2(110)

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