Matthew Neurock

Overview

Best Publications

• Reactivity of the Gold/Water Interface During Selective Oxidation Catalysis

  Bhushan N. Zope;David D. Hibbitts;Matthew Neurock;Robert J. Davis

  1187
  Citations

• Spectroscopic Observation of Dual Catalytic Sites During Oxidation of CO on a Au/TiO2 Catalyst

  Isabel Xiaoye Green;Wenjie Tang;Matthew Neurock;John T. Yates

  1100
  Citations

• First principles reaction modeling of the electrochemical interface: Consideration and calculation of a tunable surface potential from atomic and electronic structure

  Christopher D. Taylor;Sally A. Wasileski;Jean Sebastien Filhol;Matthew Neurock

  643
  Citations

• Reactivity Theory of Transition-Metal Surfaces: A Brønsted−Evans−Polanyi Linear Activation Energy−Free-Energy Analysis

  RA Rutger van Santen;Matthew Neurock;SG Sharankumar Shetty

  618
  Citations

• Chemisorption of CO and mechanism of CO oxidation on supported platinum nanoclusters.

  Ayman D. Allian;Kazuhiro Takanabe;Kyle L. Fujdala;Xianghong Hao

  616
  Citations

• Selective hydrogenolysis of polyols and cyclic ethers over bifunctional surface sites on rhodium-rhenium catalysts.

  Mei Chia;Yomaira J. Pagán-Torres;David Hibbitts;Qiaohua Tan

  586
  Citations

• Elucidation of the Electrochemical Activation of Water over Pd by First Principles

  Jean Sébastien Filhol;Matthew Neurock

  520
  Citations

• Calculated Phase Diagrams for the Electrochemical Oxidation and Reduction of Water over Pt(111)

  Jan Rossmeisl;Jens K. Nørskov;Christopher D. Taylor;Michael J. Janik

  494
  Citations

• A first principles comparison of the mechanism and site requirements for the electrocatalytic oxidation of methanol and formic acid over Pt

  Matthew Neurock;Michael Janik;Andrzej Wieckowski

  486
  Citations

• Scalable and safe synthetic organic electroreduction inspired by Li-ion battery chemistry

  Byron K. Peters;Kevin X. Rodriguez;Solomon H. Reisberg;Sebastian B. Beil

  432
  Citations

• Electronic Factors Governing Ethylene Hydrogenation and Dehydrogenation Activity of Pseudomorphic PdML/Re(0001), PdML/Ru(0001), Pd(111), and PdML/Au(111) Surfaces

  Venkataraman Pallassana;Matthew Neurock

  429
  Citations

• Mechanisms, models and methods of vapor deposition

  H.N.G Wadley;X Zhou;R.A Johnson;M Neurock

  379
  Citations

• Concepts in Theoretical Heterogeneous Catalytic Reactivity

  RA Rutger van Santen;Matthew Neurock

  351
  Citations

• Consequences of metal-oxide interconversion for C-H bond activation during CH4 reactions on Pd catalysts

  Ya-Huei Cathy Chin;Corneliu Buda;Matthew Neurock;Enrique Iglesia

  351
  Citations

• Electrochemically Driven, Ni-Catalyzed Aryl Amination: Scope, Mechanism, and Applications

  Yu Kawamata;Julien C. Vantourout;David P. Hickey;Peng Bai

  331
  Citations

• Mechanisms of methanol decomposition on platinum: A combined experimental and ab initio approach.

  D. Cao;G. Q. Lu;Andrzei Wieckowski;Sally A. Wasileski

  321
  Citations

• Hydrogenation of acetylene–ethylene mixtures over Pd and Pd–Ag alloys: First-principles-based kinetic Monte Carlo simulations

  Donghai Mei;Donghai Mei;Matthew Neurock;C. Michael Smith

  317
  Citations

• Molecular heterogeneous catalysis

  Rutger Anthony Van Santen;Matthew Neurock

  302
  Citations

• A Periodic Density Functional Theory Study of the Dehydrogenation of Methanol over Pt(111)

  Sanket K. Desai;Matthew Neurock;K. Kourtakis

  301
  Citations

• CO Chemisorption and Dissociation at High Coverages during CO Hydrogenation on Ru Catalysts

  Brett T. Loveless;Corneliu Buda;Matthew Neurock;Enrique Iglesia

  281
  Citations

• First-Principles Analysis of the Initial Electroreduction Steps of Oxygen over Pt(111)

  Michael J. Janik;Christopher D. Taylor;Matthew Neurock

  273
  Citations