Identifying Size Effects of Pt as Single Atoms and Nanoparticles Supported on FeO x for the Water-Gas Shift Reaction
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journal
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January 2018 |
Stable Pd-Doped Ceria Structures for CH 4 Activation and CO Oxidation
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journal
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November 2017 |
Catalysis on Singly Dispersed Rh Atoms Anchored on an Inert Support
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December 2017 |
Unraveling Charge State of Supported Au Single-Atoms during CO Oxidation
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journal
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January 2018 |
Activation of surface lattice oxygen in single-atom Pt/CeO 2 for low-temperature CO oxidation
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December 2017 |
Support Effects in Single-Atom Platinum Catalysts for Electrochemical Oxygen Reduction
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journal
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January 2017 |
Catalysis by Supported Single Metal Atoms
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journal
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November 2016 |
C–C Coupling on Single-Atom-Based Heterogeneous Catalyst
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journal
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January 2018 |
Single-Site Heterogeneous Catalysts
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journal
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October 2005 |
Single-atom catalysis of CO oxidation using Pt1/FeOx
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journal
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July 2011 |
Identification of single-site gold catalysis in acetylene hydrochlorination
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journal
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March 2017 |
CO2 adsorption and activation over γ-Al2O3-supported transition metal dimers: A density functional study
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journal
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September 2009 |
Pt/Cu single-atom alloys as coke-resistant catalysts for efficient C–H activation
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journal
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January 2018 |
Bimetallic Ag-Pt Sub-nanometer Supported Clusters as Highly Efficient and Robust Oxidation Catalysts
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journal
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December 2017 |
Tuning the composition of metastable Co Ni Mg100−−(OH)(OCH3) nanoplates for optimizing robust methane dry reforming catalyst
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journal
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October 2015 |
A review of dry (CO 2 ) reforming of methane over noble metal catalysts
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journal
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January 2014 |
Ni based on dual-support Mg-Al mixed oxides and SBA-15 catalysts for dry reforming of methane
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journal
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November 2013 |
The acceleration of methanol synthesis and C2 oxygenates formation on copper grain boundary from syngas
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journal
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January 2016 |
Effect of pH on catalyst activity and selectivity in the aqueous Fischer–Tropsch synthesis catalyzed by cobalt nanoparticles
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journal
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November 2015 |
Experimental and Theoretical Studies of Ethanol Synthesis from Syngas over CuZnAl Catalysts without Other Promoters
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journal
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June 2014 |
A Single‐Source Precursor Approach to Self‐Supported Nickel–Manganese‐Based Catalysts with Improved Stability for Effective Low‐Temperature Dry Reforming of Methane
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journal
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February 2016 |
Ni/CeO2–Al2O3 catalysts for the dry reforming of methane: The effect of CeAlO3 content and nickel crystallite size on catalytic activity and coke resistance
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journal
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July 2015 |
Methane decomposition to COx-free hydrogen and nano-carbon material on group 8–10 base metal catalysts: A review
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journal
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March 2011 |
Deactivation of Ni catalysts during methane autothermal reforming with CO2 and O2 in a fluidized-bed reactor
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journal
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September 2007 |
Highly active and stable nano NiO–MgO catalyst encapsulated by silica with a core–shell structure for CO 2 methanation
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journal
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January 2014 |
Support interaction of Ni nanocluster based catalysts applied in CO2 reforming
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journal
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October 2015 |
Particle size effect in the low temperature reforming of methane by carbon dioxide on silica-supported Ni nanoparticles
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journal
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January 2013 |
Solid-solution catalysts for CO2 reforming of methane
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journal
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November 2009 |
High-Resolution Transmission Electron Microscopy Study of Carbon Deposited on the NiO/MgO Solid Solution Catalysts
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journal
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May 1999 |
Syngas production from methane reforming with CO2/H2O and O2 over NiO–MgO solid solution catalyst in fluidized bed reactors
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journal
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June 2004 |
Catalytic Performance and Catalyst Structure of Nickel–Magnesia Catalysts for CO2 Reforming of Methane
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journal
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June 1999 |
An optimum NiO content in the CO2 reforming of CH4 with NiO/MgO solid solution catalysts
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journal
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September 1996 |
Carbon dioxide reforming of methane over ordered mesoporous NiO–MgO–Al2O3 composite oxides
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journal
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October 2011 |
Oxygen Vacancy: The Invisible Agent on Oxide Surfaces
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journal
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October 2003 |
CH4 dissociation on the perfect and defective MgO(001) supported Ni4
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journal
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May 2014 |
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
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journal
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October 1996 |
Projector augmented-wave method
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journal
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December 1994 |
Ab initiomolecular dynamics for liquid metals
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journal
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January 1993 |
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
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journal
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September 1992 |
Accurate and simple analytic representation of the electron-gas correlation energy
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journal
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June 1992 |
Bonding of NH 3 , CO, and NO to NiO and Ni-doped MgO: a problem for density functional theory
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journal
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June 2004 |
Density functional study of CO and NO adsorption on Ni-doped MgO(100)
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journal
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March 2010 |
Reaction pathway of CH 4 /CO 2 reforming over Ni8/MgO(100)
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journal
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June 2017 |
Insight into the reaction mechanism of CO 2 activation for CH 4 reforming over NiO-MgO: A combination of DRIFTS and DFT study
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journal
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September 2017 |
Vacancy-Driven Surface Segregation in Ni x Mg1−x O(100) Solid Solutions from First Principles Calculations
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journal
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September 2012 |
A climbing image nudged elastic band method for finding saddle points and minimum energy paths
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journal
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December 2000 |
Study on the Dispersion of Nickel Ions in the NiO−MgO System by X-ray Absorption Fine Structure
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journal
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January 1996 |
Cationic and anionic vacancies on the NiO(100) surface: DFT+U and hybrid functional density functional theory calculations
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journal
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November 2007 |
Deterministic conversion between memory and threshold resistive switching via tuning the strong electron correlation
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journal
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June 2012 |
Kinetics of desorption, adsorption, and surface diffusion of CO2 on MgO(100)
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journal
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January 1992 |
Accurate adsorption energies of small molecules on oxide surfaces: CO–MgO(001)
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journal
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January 2013 |
Adsorption of nonmetallic elements on defect-free MgO(001) surface – DFT study
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journal
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February 2015 |
Adsorption of atomic and molecular oxygen on the MgO (001) surface
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journal
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March 1997 |
Accurate quantum chemical energies for the interaction of hydrocarbons with oxide surfaces: CH4/MgO(001)
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journal
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January 2010 |
CO2 reforming of methane to syngas over highly active and stable supported CoOx (accompanied with MgO, ZrO2 or CeO2) catalysts
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journal
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January 2007 |
Ni Substitutional Defects in Bulk and at the (001) Surface of MgO from First-Principles Calculations
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journal
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November 2016 |
Kinetic aspect of CO2 reforming of CH4 on Ni(111): A density functional theory calculation
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journal
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March 2007 |
CO 2 Reforming of CH 4 on Ni(111): A Density Functional Theory Calculation
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journal
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May 2006 |
CO Hydrogenation on Pd(111): Competition between Fischer–Tropsch and Oxygenate Synthesis Pathways
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journal
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July 2013 |
DFT studies of dry reforming of methane on Ni catalyst
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journal
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November 2009 |
Active sites for CO 2 hydrogenation to methanol on Cu/ZnO catalysts
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journal
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March 2017 |
Tuning Selectivity of CO 2 Hydrogenation Reactions at the Metal/Oxide Interface
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journal
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July 2017 |
Optimizing Binding Energies of Key Intermediates for CO 2 Hydrogenation to Methanol over Oxide-Supported Copper
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journal
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September 2016 |
NIST Standard Reference Simulation Website - SRD 173
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dataset
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January 2017 |
Density Functional Theory-Assisted Microkinetic Analysis of Methane Dry Reforming on Ni Catalyst
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journal
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May 2015 |
Intrinsic reactivity of Ni, Pd and Pt surfaces in dry reforming and competitive reactions: Insights from first principles calculations and microkinetic modeling simulations
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journal
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November 2016 |
Theoretical perspective of alcohol decomposition and synthesis from CO2 hydrogenation
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journal
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June 2013 |
Fischer–Tropsch Synthesis Using H 2 /CO/CO 2 Syngas Mixtures over an Iron Catalyst
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journal
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October 2011 |
CO2 hydrogenation on Pt, Pt/SiO2 and Pt/TiO2: Importance of synergy between Pt and oxide support
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journal
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November 2016 |
Mechanism of Ethanol Synthesis from Syngas on Rh(111)
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journal
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September 2009 |
Confined catalysis under two-dimensional materials
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journal
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May 2017 |
Zeolite Structural Confinement Effects Enhance One-Pot Catalytic Conversion of Ethanol to Butadiene
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journal
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April 2017 |
Size-dependence of carbon nanotube confinement in catalysis
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journal
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January 2017 |
Interface-Confined Oxide Nanostructures for Catalytic Oxidation Reactions
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journal
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March 2013 |
Computationally Exploring Confinement Effects in the Methane-to-Methanol Conversion Over Iron-Oxo Centers in Zeolites
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journal
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November 2016 |