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RESEARCH PAPER · ACS Catalysis · 2019

Surface Reconstructions of Metal Oxides and the Consequences on Catalytic Chemistry

Felipe Polo‐Garzon, Zhenghong Bao, Xuanyu Zhang, Weixin Huang, Zili Wu

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Surface Reconstructions of Metal Oxides and the Consequences on Catalytic ChemistryOriginalQuantitative Structural Characterization of Catalytically Active TiO2 Nanoparticles17Frequencies and Thermal Stability of Isolated Surface Hydroxyls on Pyrogenic TiO2 Nanoparticles53Cationic ion-driven surface control of one-dimensional CeO2 nanocrystals to enhance catalytic performance of CO oxidation12A study on the acidity of sulfated CuO layers grown by surface reconstruction of Cu 2 O with specific exposed facets10Efficient CO 2 electroreduction to CO at low overpotentials using a surface-reconstructed and N-coordinated Zn electrocatalyst21Surface chemistry of TiO 2 connecting thermal catalysis and photocatalysis76A review of the interactions between ceria and H2 and the applications to selective hydrogenation of alkynes57Understanding morphology-dependent CuO -CeO2 interactions from the very beginning101Electrochemical Dehydrogenation of Ethane to Ethylene in a Solid Oxide Electrolyzer107The interplay between surface facet and reconstruction on isopropanol conversion over SrTiO3 nanocrystals25Dispersion of copper oxide species on nanostructured ceria36Site-Oriented Design of High-Performance Halloysite-Supported Palladium Catalysts for Methane Combustion40Bulk and Surface Properties Regulation of Single/Double Perovskites to Realize Enhanced Oxygen Evolution Reactivity48Theoretical insights into the surface physics and chemistry of redox-active oxides157Why Do We Use the Materials and Operating Conditions We Use for Heterogeneous (Photo)Electrochemical Water Splitting?150Phase segregation reversibility in mixed-metal hydroxide water oxidation catalysts428Morphology-Dependent CO Reduction Kinetics and Surface Copper Species Evolution of Cu2O Nanocrystals27Recent Advances of Ceria‐Based Materials in the Oxidation of Carbon Monoxide62Reaction-driven surface reconstruction of ZnAl2O4 boosts the methanol selectivity in CO2 catalytic hydrogenation107Recent Progresses on Structural Reconstruction of Nanosized Metal Catalysts via Controlled-Atmosphere Transmission Electron Microscopy: A Review117Toward Informed Design of Nanomaterials: A Mechanistic Analysis of Structure–Property–Function Relationships for Faceted Nanoscale Metal Oxides73Facile Strategy to Extend Stability of Simple Component-Alumina-Supported Palladium Catalysts for Efficient Methane Combustion45Inserting ultrafine NiO nanoparticles into amorphous NiP sheets by in situ phase reconstruction for high-stability of the HER catalysts43Structural and Electronic Properties of Metal Oxides and Their Applications in Solar Cells15Meso-erythritol-regulated BiOBr nanosheets with surface hydroxyl imprinting sites for considerably improved photocatalytic capability21Designing High‐Valence Metal Sites for Electrochemical Water Splitting402The Role of Dimensionality on the Optoelectronic Properties of Oxide and Halide Perovskites, and their Halide Derivatives179Sugar-regulated bismuth oxybromide flowers with active imprinting sites for efficient photooxidative ability5Ecofriendly K-decorated ZnO/Zn(Al,La)2O4 catalyst for hydrogen production – Effect of heterostructure on catalyst activity at steam‐lean process gas2Tailoring the Local Environment of Platinum in Single‐Atom Pt 1 /CeO 2 Catalysts for Robust Low‐Temperature CO Oxidation21Tailoring the Local Environment of Platinum in Single‐Atom Pt1/CeO2 Catalysts for Robust Low‐Temperature CO Oxidation189Synergistic tuning of the phase structure of alumina and ceria-zirconia in supported palladium catalysts for enhanced methane combustion12In Situ Resolving the Atomic Reconstruction of SnO2 (110) Surface37Insight into the Morphology‐Dependent Catalytic Performance of CuO/CeO2 Produced by Tannic Acid for Efficient Hydrogenation of 4‐Nitrophenol8Recent Progress on Structurally Ordered Materials for Electrocatalysis112Tuning Reconstruction Level of Precatalysts to Design Advanced Oxygen Evolution Electrocatalysts31In situ spectroscopic insights into the redox and acid-base properties of ceria catalysts43Understanding and Application of Strong Metal–Support Interactions in Conversion of CO 2 to Methanol: A Review88A Perspective on Heterogeneous Catalysts for the Selective Oxidation of Alcohols132The Effect of Water on the 2‐Propanol Oxidation Activity of Co‐Substituted LaFe1−xCoxO3 Perovskites13Influence of structure on the electrooxidation rate of six C-4 alcohols2Rational construction of thermally stable single atom catalysts: From atomic structure to practical applications50Cu 2 O Nanocrystal Model Catalysts23Current understanding of ceria surfaces for CO2 reduction in SOECs and future prospects – A review69Engineering NH3-induced 1D self-assembly architecture with conductive polymer for advanced hybrid Na-CO2 batteries via morphology modulation24Breaking through the Peak Height Limit of the Volcano-Shaped Activity Curve for Metal Catalysts: Role of Distinct Surface Structures on Transition Metal Oxides10Engineering ordered arrangements of oxygen vacancies at the surface of superconducting La2CuO4 thin films16Structure sensitivity of CuO in CO oxidation over CeO2-CuO/Cu2O catalysts68Aggregation of CeO 2 particles with aligned grains drives sintering of Pt single atoms in Pt/CeO 2 catalysts22Anion-exchange membrane water electrolyzers and fuel cells574Bi 2 O 3 nanoparticles exhibit potent broad-spectrum antimicrobial activity and the ability to overcome Ag-, ciprofloxacin- and meropenem-resistance in P. aeruginosa : the next silver bullet of metal antimicrobials?18Catalysis Chemistry of Crystalline Complex Metal Oxide Catalysts0Confinement of nano-gold in 3D hierarchically structured gadolinium-doped ceria mesocrystal: synergistic effect of chemical composition and structural hierarchy in CO and propane oxidation3Praseodymia–titania mixed oxide supported gold as efficient water gas shift catalyst: modulated by the mixing ratio of oxides7The Active Sites of Platinum-Ceria Catalysts in Propane Oxidation and Preferential Oxidation of Carbon Monoxide in Hydrogen0A review of Ni based powder catalyst for urea oxidation in assisting water splitting reaction271Studies on the Morphology Effect on Catalytic Ability of a Single MnO2 Catalyst Particle with a Solid Nanopipette12Dynamic active site evolution and stabilization of core-shell structure electrode for oxygen evolution reaction17Titanium modified Ru/CeO2 catalysts for ammonia synthesis26An attempt to tailor methane oxidation behaviors over Pd/Al2O3 systems through the concerted fashion of Zn and alkaline-metal promoters12Revealing the interplay between “intelligent behavior” and surface reconstruction of non-precious metal doped SrTiO3 catalysts during methane combustion9Optimizing the Microstructure of SnO 2 –CeO 2 Binary Oxide Supported Palladium Catalysts for Efficient and Stable Methane Combustion36Assessing the role of surface carbon on the surface stability and reactivity of β-Mo2C catalysts7Interfacial interaction-dependent in situ restructure of NiO/TiO2 photocatalysts15Deep sub-angstrom resolution imaging by electron ptychography with misorientation correction66CO2 methanation over γ-Al2O3 nanosheets-stabilized Ni catalysts: Effects of MnOx and MoOx additives on catalytic performance and reaction pathway22Size-Dependent Redispersion or Agglomeration of Ag Clusters on CeO211Surface Reconstruction of Water Splitting Electrocatalysts403Unveiling the Electrocatalytic Activity of Crystal Facet-Tailored Cobalt Oxide-rGO Heterostructure Toward Selective Reduction of CO2 to Ethanol23Reversible Atomization and Nano-Clustering of Pt as a Strategy for Designing Ultra-Low-Metal-Loading Catalysts14Insights into Chlorobenzene Catalytic Oxidation over Noble Metal Loading {001}-TiO 2 : The Role of NaBH 4 and Subnanometer Ru Undergoing Stable Ru 0 ↔ Ru 4+ Circulation70Promoting n -Butane Dehydrogenation over PtMn/SiO 2 through Structural Evolution Induced by a Reverse Water-Gas Shift Reaction29Al doped manganous oxide for high-performance aqueous Zn-ion batteries71Defect-induced electronic modification and surface reconstruction of catalysts during water oxidation process66In Situ Reconstruction NiO Octahedral Active Sites for Promoting Electrocatalytic Oxygen Evolution of Nickel Phosphate25Operando Identification of Dynamic Photoexcited Oxygen Vacancies as True Catalytic Active Sites76The role of lanthanum hydride species in La2O3 supported Ru cluster catalyst for ammonia synthesis30Identification of the Active Sites of Platinum-Ceria Catalysts in Propane Oxidation and Preferential Oxidation of Carbon Monoxide in Hydrogen13A unique octadecahedron SrTiO 3 perovskite oxide with a nano step-shaped facet structure for enhanced photoredox and hydrogen evolution performance19Accessing complex reconstructed material structures with hybrid global optimization accelerated via on-the-fly machine learning13Key Factors for Methane Combustion Over Palladium-Based Catalysts Revealed by Enhanced and Depressed Catalytic Performance0Rapid Energy Exchange between In Situ Formed Bromine Vacancies and CO 2 Molecules Enhances CO 2 Photoreduction31Recent advances in molybdenum diselenide-based electrocatalysts: preparation and application in the hydrogen evolution reaction41F-doped CeO2 supported Co-based nanoparticles for enhanced photocatalytic H2 evolution from ammonia borane26In Situ Surface Reconstruction of Catalysts for Enhanced Hydrogen Evolution26Fundamental Understanding of Nonaqueous and Hybrid Na–CO2 Batteries: Challenges and Perspectives34A review on electrocatalysis for alkaline oxygen evolution reaction (OER) by Fe-based catalysts54(2×1) Reconstruction Mechanism of Rutile TiO2(011) Surface3In Situ Neutron Scattering Studies on the Oxidation and Reduction of CeO2 and Pt–CeO2 Nanorods7Atomically visualizing cyclic self-refreshing of gas-oxide interfaces0Bonds over Electrons: Proton Coupled Electron Transfer at Solid–Solution Interfaces143Crossover from small polaron tunneling to correlated barrier hopping and its evolution with thermal instability of SnO surface6Assist of multi-walled carbon nanotubes toward metal–organic framework chamfer cube-derived rambutan-like cobalt oxide@hollow chain and its application for non-enzymatic glucose sensing10DFT and simulation of solid-liquid interface properties and processes2Metal Alloys‐Structured Electrocatalysts: Metal–Metal Interactions, Coordination Microenvironments, and Structural Property–Reactivity Relationships142Oxyanion-Coordinated Co-Based Catalysts for Optimized Hydrogen Evolution: The Feedback of Adsorbed Anions to the Catalytic Activity and Mechanism38Prediction of surface reconstructions using MAGUS10A roadmap towards sustainable anode design for alkaline water electrolysis40Surface reconstruction of Se-doped NiS2 enables high-efficiency oxygen evolution reaction149Synthesis and Specific Properties of the Ceria and Ceria-Zirconia Nanocrystals and Their Aggregates Showing Outstanding Catalytic Activity in Redox Reactions—A Review17Enhanced production and control of liquid alkanes in the hydrogenolysis of polypropylene over shaped Ru/CeO2 catalysts23Progress and Perspectives of Pulse Electrolysis for Stable Electrochemical Carbon Dioxide Reduction43Design of bifunctional ultrathin MnO2 nanofilm with laccase-like activity for sensing environmental pollutants containing phenol groups51Key factors for methane combustion over palladium-based catalysts revealed by enhanced and depressed catalytic performance43In situ preparation and determination of CeO2 high-index surface atomic structures1Traces of Potassium Induce Restructuring of the Anatase TiO2(001)-(1×4) Surface from a Reactive to an Inert Structure4Silicon-induced optimization on phase structure and surface property of Pd/ZrO2 catalysts for enhanced methane combustion13Role of defect-driven surface reconstructions in transition metal oxide electrocatalysis towards OER/ORR: A quantum-mechanical perspective30Applications and theory investigation of two-dimensional boron nitride nanomaterials in energy catalysis and storage37Magnesium-enhanced redox property and surface acidity-basicity of LaMnO3 perovskites for efficient methane purification37Ammonia decomposition for carbon-free hydrogen production over Ni/Al-Ce catalysts: Synergistic effect between Al and Ce44Templated synthesis of transition metal phosphide electrocatalysts for oxygen and hydrogen evolution reactions110Synthesis of iron oxide microparticles with fern leaf morphology: Assessment of the RY-145 azo-dye adsorption9Rapid synthesis of nanomaterials by solvent-free laser irradiation for energy storage and conversion5Identification of the Active Sites on ZnO/ZrO2 for CO2 Hydrogenation to CO and Methanol9Surface engineering of ternary mixed transition metal oxides for highly efficient catalytic oxidation of low concentration VOCs23Machine learning speeds up search for surface structure5Ions Adsorbed at Amorphous Solid/Solution Interfaces Form Wigner Crystal-like Structures26Recent insights on the use of modified Zn-based catalysts in eCO 2 RR15Composition-dependent morphologies of CeO 2 nanoparticles in the presence of Co-adsorbed H 2 O and CO 2 : a density functional theory study11Exploring Cr and molten salt interfacial interactions for molten salt applications6Recent Advances in Electrocatalytic Nitrate Reduction to Ammonia Using Metal Oxides6Homolytic H2 dissociation for enhanced hydrogenation catalysis on oxides96Role of H 2 O in Catalytic Conversion of C 1 Molecules78Complementary probes for the electrochemical interface107Cobalt group transition metals (TM: Co, Rh, Ir) coordination of S-doped porphyrins (TM_S@PPR) as sensors for molecular SO2 gas adsorption: a DFT and QTAIM study3Unveiling diverse coordination-defined electronic structures of reconstructed anatase TiO2(001)-(1 × 4) surface22Triple the steady-state reaction rate by decorating the In2O3 surface with SiO for CO2 hydrogenation22Effect of CdS on microstructure and performance of ZnO composite photocatalyst1A Review of the Structure–Property Relationship of Nickel Phosphides in Hydrogen Production5Crystal Facet Controlled Metal–Support Interaction in Uricase Mimics for Highly Efficient Hyperuricemia Treatment19Enhancement of Catalytic Activity via Inevitable Reconstruction of the Ni–Mo Interface for Alkaline Hydrogen Oxidation10Rational Control of Oxygen Vacancy Density in In2O3 to Boost Methanol Synthesis from CO2 Hydrogenation85Unraveling the significance of acid sites in determining NH3-SCR mechanisms over WO3 catalyst: A combined experimental and computational study16Insights into the Phases Transformation of Copper and Nickel Catalysts during Partial Oxidation and Steam Reforming of Methane3Redox-acidity dual modification of CuO by niobium-incorporation for enhanced selective catalytic oxidation of NH312Influence of catalyst shape on plasma-assisted dry reforming of methane: A comparative study of Ni-CeO2 nano-cubes and nano-octahedra38Synthesis of surface-engineered SrFe2O4 for efficient catalytic partial oxidation of methane4Microwave catalytic pyrolysis of biomass: a review focusing on absorbents and catalysts110Unravelling the potential of prussian blue analogues in oxygen electrocatalysis: A perspective on surface reconstruction5Standardization of Chemically Selective Atomic Force Microscopy for Metal Oxide Surfaces15Anion-Doping-Mediated Metal–Support Interactions in CeO 2 -Supported Pd Catalysts for CO 2 Hydrogenation32Improving H2 gas sensing with ZnMn2O4/Polypyrrole Nanocomposite20Perspective about gasoline soot combustion over ceria catalysts: A close look into the “active oxygen” enigma12Surface ligand-promoted heterogeneous CO2 catalysis9Mo‐Induced Surface Reconstruction in Ni/Co‐OOH Prickly Flower Clusters for Improving the Hydrogen Production in Alkaline Seawater Splitting7Zinc oxide morphology-dependent CuOx-ZnO interactions and catalysis in CO oxidation and CO2 hydrogenation10Target-Navigated CBT–Cys “Stapling” Coupled with CRISPR/Cas12a Amplification for the Photoelectrochemical Nucleic Acid Assay47Atomically Resolved Surface Reconstruction of WO 3 (002)6Unveiling the Electrocatalytic Hydrogen Evolution Reaction Pathway on RuP2 through Ab Initio Grand Canonical Monte Carlo10

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