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RESEARCH PAPER · Chemical Reviews · 2023

Crystal-Phase Engineering in Heterogeneous Catalysis

Jianwen Zhao, Hong-Yue Wang, Feng Li, Jin-Ze Zhu, Jin‐Xun Liu, Wei‐Xue Li

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Crystal-Phase Engineering in Heterogeneous CatalysisOriginalCrystal Phase-Induced Electronic Structure Modulation at Mn Sites Enhances Singlet Oxygen Generation for Selective Catalytic Ozonation Of Nh4+0Dynamic transformation of active sites in energy and environmental catalysis140Performance and Mechanism Investigation of Cu Loading and S Vacancy Synergistic Promotion of Mos2 Catalyzed Water Gas Shift Reaction: Experimental and Theoretical Calculations0Metastable-Phase Two-Dimensional Metal Oxides for Advanced Electrocatalysis8Phase engineering of Ru-based nanocatalysts for enhanced activity toward CO2 methanation11Formation of ferromagnetic Fe5Se8 via phase transition and enhanced hydrogen evolution reaction with alternating magnetic fields4Bioethanol as a Sustainable Platform Molecule for the Synthesis of Chemical Commodities1Tuning the Selectivity of Catalytic Nitrile Hydrogenation with Phase-Controlled Co Nanoparticles Prepared by Hydrosilane-Assisted Method24Phase-Engineered MoSe 2 /CeO 2 Composites for Room-Temperature Gas Sensing with a Drastic Discrimination of NH 3 and TEA Gases65Performance and mechanism investigation of Cu loading and S vacancy synergistic promotion of MoS2 catalyzed low-temperature water gas shift reaction: Experimental and theoretical calculations11Phase Engineering of ZnSe by Small Molecules as a High‐Performance Protective Layer for Zn Anode1Calcium single atoms stabilized by nitrogen coordination in metal–organic frameworks as efficient solid base catalysts11Interface-rich porous Fe-doped hcp-PtBi/fcc-Pt heterostructured nanoplates enhanced the C C bond cleavage of C3 alcohols electrooxidation4Chemically Driven Crystal Phase Selective Transformation of Covellite CuS Nanocrystals10Multi-Band Centre Co-Tailoring of Iridium Diphosphide Nanoclusters Motivating Industrial Current Density Hydrogen Production14Heterophase hexagonal/orthorhombic molybdenum trioxide nanorods for photocatalytic hydrogen production5Redefining the Symphony of Light Aromatic Synthesis Beyond Fossil Fuels: A Journey Navigating through a Fe-Based/HZSM-5 Tandem Route for Syngas Conversion26Transition Metal Dichalcogenides in Electrocatalytic Water Splitting29A Porphyrin-Based sp2 Carbon-Conjugated covalent organic polymer containing flexible chains for efficient heterogeneous photocatalysis2Facile Synthesis of Rhodium‐Based Nanocrystals in a Metastable Phase and Evaluation of Their Thermal and Catalytic Properties7MOF-derived phase-selective synthesis of ln2O3 with appropriate surface atomic arrangement for CO2 photoreduction11Dual chalcogenide coordination engineering on a self-supported alloy electrode for enhanced hydrogen evolution reaction2Tuning Strategies of Indium‐Based Catalysts for Electrocatalytic Carbon Dioxide Reduction7Crystal-Phase Engineering of PdCu Nanoparticles for Catalytic Reduction of NO by CO5Synergism between {111} and {100} Crystal Facets on Cu 2 O for Boosted Photothermal Catalysis8A one-dimensional edge state induced by strain in a copper nitride monolayer on Cu(001)1Dynamic reconstruction regulation of α/β-CoMoO 4 through phase engineering for enhanced alkaline water electrolysis10Microkinetics-guided catalyst design for low-temperature CO catalytic oxidation4Rapid synthesis of metastable materials for electrocatalysis45In-situ Fe2O3 generation-induced tunable proton transfer enhancement of Zr-modified sepiolite for energy-efficient and sustainable amine-based CO2 capture5Size-Dependent Phase Transformation and Vacancy Formation Drive Highly Efficient Removal of Cadmium with ZnS1MOF-Based Electrocatalysts: An Overview from the Perspective of Structural Design307Recent advances and challenges of double-atom catalysts in diverse environmental applications: A state-of-the-art review33The First‐Principles Investigation of CO Adsorption on Pd(100) Surface Supported Pd–Cu Nanoclusters0Machine learning-driven molecular dynamics unveils a bulk phase transformation driving ammonia synthesis on barium hydride51Crystal phase-induced electronic structure modulation at Mn sites enhances singlet oxygen generation for selective catalytic ozonation of NH4+20Crystal plane regulation and heterostructure construction of ZnIn2S4/h-BN for boosting photocatalytic hydrogen evolution21Applying Electromagnetic Wet Quenching to Realize Crystal-Phase Engineering of Metal Oxides for Enhanced Catalytic Oxidation5Carbon‐Extraction‐Triggered Phase Engineering of Rhodium Nanomaterials for Efficient Electrocatalytic Nitrate Reduction Reaction27Carbon‐Extraction‐Triggered Phase Engineering of Rhodium Nanomaterials for Efficient Electrocatalytic Nitrate Reduction Reaction2Phase-Dependent Synthesis of Ru Grown on TiO2 for Solar Driven H2 Evolution13Revealing the influence of surface structure on the fabrication of Pt-based alloy nanowires induced by H2 and their electrocatalytic upcycling of polyethylene terephthalate5Rational design of transition metal-based heterostructure electrocatalysts for high-performance oxygen evolution reaction18Cu-Facet Selective Sulfur Chemistry for Ultrastable Sodium–Sulfur Batteries31Glimpsing the Dynamics at Solid–Liquid Interfaces Using In Situ/Operando Synchrotron Radiation Techniques1Groove-Confined Cobalt Catalyst for Low-Temperature CO 2 Activation6Enhanced photocatalytic ammonia oxidation over Ag/WO3 via simultaneously steering the activation for N–H bonds and oxygen species6Hydrogen spillover effect in CO2 hydrogenation: modulations, characterization and applications12Tailoring of Crystal Phase Distinct Cu 2– x S Templates for Polymorphic Synthesis of Binary Metal Sulfide Nanoparticles3Tailoring ZnOx Species Confined on ZrO2 Support for Enhanced CO Hydrogenation3Metal-organic framework composites for green catalysis: Coordination chemistry approaches to sustainable energy and environmental solutions32Rational design strategies of catalysts for interfacial microenvironment modification in electrochemical water splitting1Single-atom alloys for sustainability-related electrocatalytic applications1Insights into the state-of-the-art advancements in morphology and electronic structure engineering on cobalt diselenide-based nanomaterials for hydrogen evolution reaction3Crystalline Structure Engineering of Metal Sulfides Toward Advanced Sodium‐Ion Storage8Multiphase NiCoFe-Based LDH for Electrocatalytic Sulfion Oxidation Reaction Assisting Efficient Hydrogen Production22D Materials for Emerging Neuromorphic Vision: From Devices to In‐Sensor Computing13Atomic Control of Surface Active Site Isolation in Pd2Sn Nanocatalysts via Crystal Phase to Enhance Hydrogenation Selectivity3Synergistically modulating the d-band center of Ni3Se2 via Ce and Fe co-doping for efficient degradation of florfenicol in heterogeneous electro-Fenton process4Dual‐phase CoFe 2 S 4 /CoFe 2 O 4 nanoflowers with multiple interfacial polarization responses for superior electromagnetic wave absorption8Facet Engineering‐Modulated Electrochemiluminescence of Reticular Crystalline Nanoemitters2Generating Strongly Basic Sites on C/Fe3O4 Core–Shell Structure: Preparation of Magnetically Responsive Mesoporous Solid Strong Bases Catalysts2Impact of Coordination Environment for Designing Ru‐Based Alloy Catalysts for Ammonia Decomposition10Impact of Coordination Environment for Designing Ru‐Based Alloy Catalysts for Ammonia Decomposition3Luffa-like Interconnective Porous Nanofiber with Anchored Co/CoCr2O4 Hybrid Nanoparticles for Zinc–Air Batteries0Regulation strategies in ruthenium-based metal chalcogenides for enhanced electrocatalytic hydrogen evolution12Amorphous monolayer CuPd catalysts for selective semihydrogenation15Electronic modulation of Ni sites via intermetallic structure in Al-Ni/Al2O3 catalysts for efficient semi‑hydrogenation of alkynes2Development of high-performance NH3 gas sensor through novel MoSe2/PANI/Ti3C2Tx composite for medical diagnosis and industrial applications15Fundamental Mechanisms, Synthesis Strategies and Key Challenges of Transition Metal Borides for Electrocatalytic Hydrogen Evolution40Stimulating Efficiency for Proton Exchange Membrane Water Splitting Electrolyzers: From Material Design to Electrode Engineering23Topology-controlled Pt atomic sites enhance electron utilization efficiency for NAD+ regeneration and alcohol detoxification0High-performance multimetal broccoli-like structure MnMoO4/CoWO4/NF nanocomposite as a bifunctional electrocatalyst for efficient water splitting3Looping metal-support interaction in heterogeneous catalysts during redox reactions16Phase Engineering of Nickel Phosphides for Simultaneous Enhancement of Activity, Selectivity, and Stability Toward Electrocatalytic Ammonia Synthesis1Evaluating the influence of calcination temperature on the performance of CuFe2O4 as an oxygen carrier in chemical-looping gasification of biochar for hydrogen-rich syngas2Intermediate Phase-Ordering in Pd–Cd–Zn Electrocatalysts for Accelerated Alkaline Hydrogen Evolution4Carbon dot-bridge-constructed Z-scheme heterojunction for photocatalytic degradation of waterborne pollutants under visible light4Defect engineering of Ni3N/Mo2C heterostructure for enhanced alkaline hydrogen evolution reaction performance1Interfacial engineering of Cu9S5@MoS2 p-n type heterojunction via in situ phase separation for highly efficient electrocatalytic oxidation of 5-hydroxymethylfurfural12Gas-Mediated Dynamic Structure Evolution of Bimetallic Alloy Catalysts2Boosting catalytic dye degradation in Fe2O3 nanozyme through Cu-doping mediated phase transformation2Light-Driven Trap Engineering in Direct Z-Scheme Channels for Ultrafast N 2 Fixation1Pt-Triggered Reversal in Acetone Sensing: Crystal Phase-Dependent Dispersion Governs Performance of Fe 2 O 31Triple‐Atom and High‐Entropy Catalysts: Advanced Architectures for Efficient Thermally Driven Organic Transformations5A crystal-phase-tailored metal heterojunction for dual-site acceleration of alkaline hydrogen evolution1Phase Interface Engineering of Cu 1 Co Single Atom Alloy Catalysts for Enhanced Hydrogen Production from Methanol Decomposition0Phase Engineering of Nanogold: Non‐Close Packed Square Planes in A′B′ Stacking with a 0.5 Å Channel2Ambient Electrochemical Ammonia Synthesis From Various Nitrogen Sources7Facet-defined single-crystalline nanocrystals via solution synthesis for electrocatalysis1Machine learning-based prediction for stability of hydrogen species on metal-doped CeO 2 (111) surfaces0Fully automated and high-fidelity robotic platform enabling accelerated discovery of nanocatalysts2Partial Phase Transition to Construct Amorphous‐Crystalline Heterophase Catalyst for Enhanced CO 2 Photoreduction0Crystal structure control of RuCuRhIrPt high-entropy alloy nanoparticles with a face-centered cubic or hexagonal close-packed phase1Dual-site adsorption regulation on a bcc/fcc heterophase PdCuIn metallene for efficient urea electrosynthesis1Encapsulation of Cu nanoparticles within TS-1 zeolite: synergistic Cu–N coordination and CuO(111)/Cu(111) facet engineering for enhanced 1,4-butynediol synthesis0Facile synthesis of a CuO/CoOOH composite electrocatalyst for efficient glucose electrooxidation0Flexoelectric catalysis: mechanisms, material designs, and synergistic strategies4Metal–support interactions via multidimensional regulation in key electrocatalytic reactions0Toward stable operation for thermochemical conversion of biomass and waste: ash chemistry for understanding ash adhesion at high temperatures1Phase‐Engineered Catalysts for Photocatalytic Conversion of C 1 Molecules7Tuning the Crystal Phases of SnIn 4 S 8 for Precise Regulation of C 1 /C 2 Products Selectivity in Photocatalytic CO 2 Reduction5Nonequilibrium pulsed heating freezes sintering of supported metal nanocatalysts11Facile and optimized synthesis of NiMo/δ-Al2O3 catalysts toward enhanced hydrodesulfurization1Data-Driven Electrocatalyst Discovery: Recent Trends in Machine Learning Approaches and Descriptor-Based Design Principles19Structural Tuning of Nanostructures: Influence of Polymorphism and Stoichiometry on Photo‐ and Electrocatalytic Performance3Phase diversity driven mechanistic landscapes for nitrate to ammonia electrosynthesis4Research progress on composite electrocatalysts for alkaline hydrogen oxidation reaction0In situ Mo-leaching constructs Ni-Co hydroxide solid solution nanorods for synergistic alkaline hydrogen evolution1A Perspective on Employing Computational Approaches to Interrogate Catalyst Restructuring1Research progress on performance regulation strategies for copper-based nitrate reduction catalysts for ammonia synthesis7Mechanism-Oriented Catalyst Design Strategies for Ethylene Glycol Electrooxidation8Defect-Engineered MoS 2 to Anchor Fe Clusters for CO 2 Hydrogenation to Methanol6Crystalline/Amorphous Interface Engineering for Superior Sodium-Ion Storage2Phase-Modulated Reaction Kinetics on ZnIn 2 S 4 /In 2 O 3 Heterostructures for Photocatalytic CO 2 Reduction1A Review of CO2 Electroreduction to Ethanol: C–C Coupling Mechanistic Insights and Catalyst Design6Facet polarization electric field and Fe single-atom co-regulate bulk carriers separation for photocatalytic nitrogen fixation2Charge self-modulation of the NiCo-OH/FeOOH heterostructure for industrial-current-density oxygen evolution reaction1Modulating Intermediate Adsorption and Interfacial Water Structure to Unlock the Potential of Nickel for Ammonia Electrosynthesis and Zn‐NO 3 − Battery2Forward-Reverse Bismuth Doping Enables an Anisotropic Transition From Stable to Metastable Ruthenium for Alkaline Hydrogen Evolution0Sustainable preparation of nitrogen-rich tungsten nitride (W2N3)@carbon nanohybrids for efficient oxidative desulfurization0From Single Motif to Active Ensembles: Phase‐Controlled Co 8 Cluster Catalysis on MoS 2 for Nitrogen Electroreduction0From Solvent Choice to Catalytic Performance: Redefining the Washing Step for Hydroxyl-Mediated Architecture Engineering0Pre‐Amination‐Directed In Situ Growth of Supported High‐Index Faceted Noble Metal Nanocrystals0Thermal-engineered structural evolution of Co/C composites: balancing mass transfer and intrinsic activity for high-power direct borohydride fuel cell0Mechanistic understanding of the 4-nitrophenol reduction as a model catalytic reaction: Advances, controversies, and perspectives4Hcp-Ni derived highly dispersed and stable Ni/Al2O3 catalysts for CO2 methanation0Catalytic Dehydrogenation Enhanced by Controlling Platinum Nanoparticle Density0Crystal phase-driven electronic metal-support interactions in Ru/Nb2O5 catalysts enable efficient low-temperature acetone oxidation0Crystal Phase Tailored Noble Metal–Based Nanocatalysts0Hexagonal Close-Packed 2H-Cu Nanocrystals1Mechanochemical engineering of interfacial M-Ov-Ni sites in CeZrO/Ni catalysts for reinforced low-temperature CO2 methanation1Dual-atom catalysts with unique electronic structures for energy-related electrocatalysis0Subangstrom spatial regulation of Fe1-N4 coordination structure for remarkably efficient C−H bond oxidation0A review of transition metal-based double perovskite oxides for photovoltaic applications0Activating inert atomic sites in heterogeneous catalysis: multi-scale design strategies0Time-programmed hydrogen reduction reconstructs ZnCo2O4/CoO heterostructures for room-temperature nonanal sensing0Melamine-induced molecular bridge facilitates the synthesis of highly strained ordered Pt3Co catalysts for fuel cells0Crystallinity-Induced Interfacial Electron Rearrangement Enables Ultrafast Fenton-Like Redox Cycling0Dislocation Engineering Steers Reaction‐Induced Reconstruction of Vanadium Oxides for Selective Oxidation of Ethane0Engineering charge-carrier dynamics in semiconductor photocatalysts: from fundamental mechanisms to stability control and mixed-pollutant photodegradation0Learning Interpretable Activity Descriptors Directly from Measurement Features in Heterogeneous Catalysis0Recent Progress of Ultrasound Therapy for Antibacterial Applications0Transition metal dichalcogenides-based flexible transistors: from material and interface engineering to intelligent system integration0Phase‐Engineered Electronic Structure of ZrO 2 Regulates the Kinetic Thermodynamic Balance of Polyiodide Chemistry in Aqueous Zn–I 2 Batteries0Nanoscale Thermocatalysis: Mechanisms, Regulation, and Biomedical Applications0Crystal Phase-Dependent Electronic Metal-Support Interactions Enable Chemoselective Hydrogenation of α, β-Unsaturated Aldehydes0

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  3. Performance and Mechanism Investigation of Cu Loading and S Vacancy Synergistic Promotion of Mos2 Catalyzed Water Gas Shift Reaction: Experimental and Theoretical Calculations

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  43. Rational design of transition metal-based heterostructure electrocatalysts for high-performance oxygen evolution reaction

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