Joseph Gauthier
Joseph Gauthier
Assistant Professor at Texas Tech University
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Solvation Effects for Oxygen Evolution Reaction Catalysis on IrO2(110)
JA Gauthier, CF Dickens, LD Chen, AD Doyle, JK NÝrskov
The Journal of Physical Chemistry C 121 (21), 11455-11463, 2017
Challenges in Modeling Electrochemical Reaction Energetics with Polarizable Continuum Models
JA Gauthier, S Ringe, CF Dickens, AJ Garza, AT Bell, M Head-Gordon, ...
ACS Catalysis 9 (2), 920-931, 2018
Unified approach to implicit and explicit solvent simulations of electrochemical reaction energetics
JA Gauthier, CF Dickens, HH Heenen, S Vijay, S Ringe, K Chan
Journal of chemical theory and computation 15 (12), 6895-6906, 2019
Solvation at metal/water interfaces: An ab initio molecular dynamics benchmark of common computational approaches
HH Heenen, JA Gauthier, HH Kristoffersen, T Ludwig, K Chan
The Journal of Chemical Physics 152 (14), 144703, 2020
Dipole-Field Interactions Determine the CO2 Reduction Activity of 2D Fe–N–C Single-Atom Catalysts
S Vijay, JA Gauthier, HH Heenen, VJ Bukas, HH Kristoffersen, K Chan
Acs Catalysis 10 (14), 7826-7835, 2020
Predicting chemical reaction barriers with a machine learning model
AR Singh, BA Rohr, JA Gauthier, JK NÝrskov
Catalysis letters 149, 2347-2354, 2019
Solvent–adsorbate interactions and adsorbate-specific solvent structure in carbon dioxide reduction on a stepped Cu surface
T Ludwig, JA Gauthier, KS Brown, S Ringe, JK NÝrskov, K Chan
The Journal of Physical Chemistry C 123 (10), 5999-6009, 2019
Understanding the apparent fractional charge of protons in the aqueous electrochemical double layer
LD Chen, M Bajdich, JMP Martirez, CM Krauter, JA Gauthier, EA Carter, ...
Nature communications 9 (1), 3202, 2018
Facile Electron Transfer to CO2 during Adsorption at the Metal|Solution Interface
JA Gauthier, M Fields, M Bajdich, LD Chen, RB Sandberg, K Chan, ...
The Journal of Physical Chemistry C 123 (48), 29278-29283, 2019
Practical Considerations for Continuum Models Applied to Surface Electrochemistry
JA Gauthier, CF Dickens, S Ringe, K Chan
ChemPhysChem 20 (22), 3074-3080, 2019
Electrolyte effects on the stability of Ni− Mo cathodes for the hydrogen evolution reaction
JHJ Wijten, RL Riemersma, J Gauthier, LDB Mandemaker, M Verhoeven, ...
ChemSusChem 12 (15), 3491-3500, 2019
Solar-driven electrochemical synthesis of ammonia using nitrate with 11% solar-to-fuel efficiency at ambient conditions
NC Kani, JA Gauthier, A Prajapati, J Edgington, I Bordawekar, W Shields, ...
Energy & Environmental Science 14 (12), 6349-6359, 2021
The Role of Roughening to Enhance Selectivity to C2+ Products during CO2 Electroreduction on Copper
JA Gauthier, JH Stenlid, F Abild-Pedersen, M Head-Gordon, AT Bell
ACS Energy Letters 6 (9), 3252-3260, 2021
Atomistic insight into cation effects on binding energies in Cu-catalyzed carbon dioxide reduction
T Ludwig, JA Gauthier, CF Dickens, KS Brown, S Ringe, K Chan, ...
The Journal of Physical Chemistry C 124 (45), 24765-24775, 2020
The mechanism for acetate formation in electrochemical CO (2) reduction on Cu: selectivity with potential, pH, and nanostructuring
HH Heenen, H Shin, G Kastlunger, S Overa, JA Gauthier, F Jiao, K Chan
Energy & Environmental Science 15 (9), 3978-3990, 2022
Micro-kinetic model of electrochemical carbon dioxide reduction over platinum in non-aqueous solvents
BA Rohr, AR Singh, JA Gauthier, MJ Statt, JK NÝrskov
Physical Chemistry Chemical Physics 22 (16), 9040-9045, 2020
Transition metal arsenide catalysts for the hydrogen evolution reaction
JA Gauthier, LA King, FT Stults, RA Flores, J Kibsgaard, YN Regmi, ...
The Journal of Physical Chemistry C 123 (39), 24007-24012, 2019
Challenges for density functional theory: calculation of CO adsorption on electrocatalytically relevant metals
CN Lininger, JA Gauthier, WL Li, E Rossomme, VV Welborn, Z Lin, ...
Physical Chemistry Chemical Physics 23 (15), 9394-9406, 2021
Pathways for the Formation of C2+ Products under Alkaline Conditions during the Electrochemical Reduction of CO2
JA Gauthier, Z Lin, M Head-Gordon, AT Bell
ACS Energy Letters 7 (5), 1679-1686, 2022
Implications of the fractional charge of hydroxide at the electrochemical interface
JA Gauthier, LD Chen, M Bajdich, K Chan
Physical Chemistry Chemical Physics 22 (13), 6964-6969, 2020
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