A theoretical study of the reverse water‐gas shift reaction on Ni(111) and Ni(311) surfaces

In Situ Exsolution of Bimetallic Rh–Ni Nanoalloys: a Highly Efficient Catalyst for CO2 Methanation

(2018) Hamidreza Arandiyan et al.   ACS Applied Materials & Interfaces

Optimization and Control of a Thin Film Growth Process: A Hybrid First Principles/Artificial Neural Network Based Multiscale Modelling Approach

(2018) Donovan Chaffart et al.   COMPUTERS & CHEMICAL ENGINEERING

Catalyst Screening and Kinetic Modeling for CO Production by High Pressure and Temperature Reverse Water Gas Shift for Fischer–Tropsch Applications

(2017) Francisco Vidal Vázquez et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Distributional uncertainty analysis and robust optimization in spatially heterogeneous multiscale process systems

(2016) Donovan Chaffart et al.   AICHE JOURNAL

Hydrogenation of CO2to Formic Acid with a Highly Active Ruthenium Acriphos Complex in DMSO and DMSO/Water

(2016) Kai Rohmann et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Morphology-Directed Selective Production of Ethylene or Ethane from CO2on a Cu Mesopore Electrode

(2016) Ki Dong Yang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Intrinsic kinetics of plasmon-enhanced reverse water gas shift on Au and Au–Mo interfacial sites supported on silica

(2016) Insoo Ro et al.   APPLIED CATALYSIS A-GENERAL

Measurement of intrinsic catalytic activity of Pt monometallic and Pt-MoO x interfacial sites over visible light enhanced PtMoO x /SiO 2 catalyst in reverse water gas shift reaction

(2016) Insoo Ro et al.   JOURNAL OF CATALYSIS

CO 2 hydrogenation on Pt, Pt/SiO 2 and Pt/TiO 2 : Importance of synergy between Pt and oxide support

(2016) Shyam Kattel et al.   JOURNAL OF CATALYSIS

CO Dissociation on Face-Centered Cubic and Hexagonal Close-Packed Nickel Catalysts: A First-Principles Study

(2016) Jin-Xun Liu et al.   Journal of Physical Chemistry C

Reducing CO2 to CO and H2O on Ni(110): The Influence of Subsurface Hydrogen

(2016) Wei Lin et al.   Journal of Physical Chemistry C

Attempts To Catalyze the Electrochemical CO2-to-Methanol Conversion by Biomimetic 2e– + 2H+ Transferring Molecules

(2016) Jean-Michel Saveant et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Nickel–Gallium-Catalyzed Electrochemical Reduction of CO2 to Highly Reduced Products at Low Overpotentials

(2016) Daniel A. Torelli et al.   ACS Catalysis

Identification of relevant active sites and a mechanism study for reverse water gas shift reaction over Pt/CeO 2 catalysts

(2016) Xiaodong Chen et al.   Journal of Energy Chemistry

Insights into the mechanisms of CO 2 methanation on Ni(111) surfaces by density functional theory

(2015) Jun Ren et al.   APPLIED SURFACE SCIENCE

Density Functional Theory-Assisted Microkinetic Analysis of Methane Dry Reforming on Ni Catalyst

(2015) Chen Fan et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Mechanistic Insights into CO2 Activation via Reverse Water–Gas Shift on Metal Surfaces

(2015) Luca Dietz et al.   Journal of Physical Chemistry C

Plasmon-enhanced reverse water gas shift reaction over oxide supported Au catalysts

(2015) Aniruddha A. Upadhye et al.   Catalysis Science & Technology

Reactive removal of surface oxygen by H2, CO and CO/H2 on a Au/CeO2 catalyst and its relevance to the preferential CO oxidation (PROX) and reverse water gas shift (RWGS) reaction

(2015) L. C. Wang et al.   Catalysis Science & Technology

FePt nanodendrites with high-index facets as active electrocatalysts for oxygen reduction reaction

(2015) Di-Yan Wang et al.   Nano Energy

The Optimally Performing Fischer-Tropsch Catalyst

(2014) Ivo A. W. Filot et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Mechanistic study of the effect of chlorine on selective CO methanation over Ni alumina-based catalysts

(2014) Toshihiro Miyao et al.   APPLIED CATALYSIS A-GENERAL

Uncertainty analysis and robust optimization of multiscale process systems with application to epitaxial thin film growth

(2014) Shabnam Rasoulian et al.   CHEMICAL ENGINEERING SCIENCE

Quantum chemistry of the Fischer–Tropsch reaction catalysed by a stepped ruthenium surface

(2014) I. A. W. Filot et al.   Catalysis Science & Technology

Structure sensitivity of CO methanation on Co (0001), and surfaces: Density functional theory calculations

(2013) Jin-Xun Liu et al.   CATALYSIS TODAY

Crystallographic Dependence of CO Activation on Cobalt Catalysts: HCP versus FCC

(2013) Jin-Xun Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mechanism and microkinetics of the Fischer–Tropsch reaction

(2013) R. A. van Santen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Enhanced low-temperature activity of CO2 methanation over highly-dispersed Ni/TiO2 catalyst

(2013) Jie Liu et al.   Catalysis Science & Technology

Methane dissociation on Ni (100), Ni (111), and Ni (553): A comparative density functional theory study

(2012) Jingde Li et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Current challenges in the design and control of multiscale systems

(2011) Luis A. Ricardez-Sandoval   CANADIAN JOURNAL OF CHEMICAL ENGINEERING

Size and Topological Effects of Rhodium Surfaces, Clusters and Nanoparticles on the Dissociation of CO

(2011) Ivo A. W. Filot et al.   Journal of Physical Chemistry C

CO2 Hydrogenation to Formic Acid on Ni(111)

(2011) Guowen Peng et al.   Journal of Physical Chemistry C

DFT studies of dry reforming of methane on Ni catalyst

(2009) Yi-An Zhu et al.   CATALYSIS TODAY

Density Functional Theory Comparison of Water Dissociation Steps on Cu, Au, Ni, Pd, and Pt

(2009) Abhijit A. Phatak et al.   Journal of Physical Chemistry C

Hydrogen-Assisted Transformation of CO2 on Nickel: The Role of Formate and Carbon Monoxide

(2009) Erik Vesselli et al.   Journal of Physical Chemistry Letters