Journal of Physical Chemistry C

Article	Citations
Comprehensive Study of Transient Mass Transport to Platinum Interdigitated Electrode Arrays to Perform Electrochemical pH Adjustment: Experimental and Numerical	359
Phase Transition and Mechanical Properties of Scandium Diboride under High Pressure	109
Phase Evolution, Structural Transformations, and Reaction Kinetics during Mechanochemical Formation of NaFeF3 from Binary Fluorides	102
Ligand Substitutional Effects on Molecular Dynamics and Broadband Near-White Emission in 2D 2-Fluoroethylammonium Cadmium Chlorobromide	96
Robust Ohmic Contact in Monolayer ZrI2 Coupled with Cold Metal	95
Bromination-Enhanced Chiral Interactions for Triphenylamine on Au and Ag(111)	93
Stability of Iridium Single Atoms on Fe3O4(001) in the mbar Pressure Range	80
Nature of Spin-Glass Behavior of Cobalt-Doped Iron Disulfide Nanospheres Using the Monte Carlo Method	78
Thermal Stability of Ionic Compounds on Nanostructured Metal Catalysts: Conversion of Quaternary Ammonium to Amines on Gold Nanoparticles	75
Crowding-Out Effect in Synergistic C–C Coupling on PdNi Alloy Nanoparticles Studied by Surface-Enhanced Raman Spectroscopy	72
Magnetostructural Correlations in a Layered Perovskite: K2CuF4 at Large Compression	72
Type II Germanium Clathrates from Zintl Phase Precursor Na4Ge4: Understanding Desodiation Processes and Sodium Migration Using First-Principles Calculations	71
Ab Initio Molecular Dynamics Simulation Study on Phosphorus/Boron Co-Doped Si Nanocrystals/SiO2 Core/Shell Structures	70
Computational Insights into Alloying and Confinement Effects on Promoted Activity and Selectivity of C2 Oxygenate over Rh-Based Catalysts	68
Two-Dimensional Central Fused Ring Enabled High-Performance Quad-Rotor-Shaped Nonfullerene Acceptor Materials	67
Tip-Induced Dissociation of Diethyl Ether on Si(001)─Influence of Molecular Structure on Final Reaction Products	66
Direct Visualization of Aluminum Particle Wetting on Carbon Using In Situ Laser Heating TEM	65
Theoretical Prediction and High-Pressure Synthesis of New LISICON-Type Solid-State Electrolyte Li2.75[B0.625P0.125S0.25]O3.375	65
Growth and Electronic Properties of SnSe2 Films on Reconstructed, (111)-Oriented SrTiO3 Substrates	64
Tuning Preferential Molecular Adsorption and Self-Assembled Molecular Network Formation at the Liquid–Solid Interface: The Impact of Annealing and Confinement	61
Computational Insight into Selective Hydrogenolysis over Monomeric MoOx-Modified Rh Catalysts in the Aqueous Phase	60
Vibration Promotes Mass Transfer of Products in Photoelectrochemical Water Splitting by Enhancing Forced Convection	59
Surface Energies of LaMnO3 High-Index Surfaces Obtained from Density-Functional Theory	59
On-Surface Synthesis of Three-Dimensional Graphene Nanoribbons via a [2 + 2] Cycloaddition Reaction and Their Planarization	57
Issue Editorial Masthead	57

Charge Transfer Dynamics of Core–Shell Quantum Dots and MoS2 Nanocomposites Using Transient Absorption Spectroscopy	57
Combined Ionic Size and Electrode Spacing Effects on the Differential Capacitance of Confined Electrolytic Cells	57
Vacancy-Driven Sizable Shift Current in Centrosymmetric Materials	57
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Depolarization via Coherently Activated Plasmonic Metasurfaces	56
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Issue Editorial Masthead	55
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Emergence of New Nitrogen-Rich Compounds in Lead–Nitrogen Phase Diagram Under Pressure	51
Mechanism Exploration of Black Phosphorus Quantum Dots for Hydrogen Peroxide Modulation in Tumor Microenvironments	50
Does F4TCNQ Adsorption on Cu(111) Form a 2D-MOF?	50
Experimental Analysis of the Elastic Moduli of Atomically Thin Transition Metal Dichalcogenides	49
Low-Temperature Electron Spin Resonance Study of MnPS3 Antiferromagnetic Single Crystal	49
Direct Laser Patterning of Polymeric Structures Containing Gold Nanoparticles and Demonstration of Its Nonlinear Optical Effect	48
The Roles of Oxygen Vacancies in Boosting Oxygen Evolution Reaction over Perovskite CeFeO 3−δ /NF Catalysts: An Experimental and Theoretical Investig	48
Screening of Ionic Liquid-Based Electrolytes for Al Dual-Ion Batteries: Thermodynamic Cycle and Combined MD-DFT Approaches	47
On-Surface Alcohol Formation from a Carbene Precursor	47
Intrinsic Defects of Vacancy-Ordered Perovskite Cs2TiIBr5 for Solar Cells	46
Cellulose Nanofibers Impart Melt Resistance to Ice through Optical and Thermal Mechanisms	46
Stability and Diffusion of Oxygen Vacancies in LaNiO 3 : A DMFT Study	46
Impact of Polarization Effect on Exciton Binding Energies and Charge Transport for the Crystals of Chlorinated ITIC Derivatives	46
Waveguide-Based Spectroelectrochemical Characterization of Band Edge Energies in Submonolayers of CdSe Quantum Dots Tethered to Indium–Tin Oxide Electrodes	46
Correction to “Surface Plasmon-Coupled Directional Emission Enhanced Raman Scattering Based on Waveguide Coupling Surface Plasmon Resonance Configuration”	46
First-Principles Study of O2 Activation over Pd Adclusters and Embedded Clusters in Pd–Au Bimetallic Surfaces	46
Metal–Support Electronic Coupling in Re 2 /NiO Enables Early N≡N Bond Cleavage and Dissociative N 2	46
Correction to “Energies of Formation Reactions Measured for Adsorbates on Late Transition Metal Surfaces”	45
Improved Photocatalytic O2 Evolution on a Sillén–Aurivillius Perovskite Oxychloride Bi6NbWO14Cl by Rh2O3 Additives and Surface Modifications	45
Toward Instant Prediction of Metal Adatom Diffusion Barriers for Understanding of Sintering and Catalyst Durability	45
Pseudohalide Anion Surface Engineering for Mixed Cation Perovskite Nanocrystals	44
Mechanism of Solvent Engineering for Controlling the Room-Temperature Crystallization Kinetics of MAPbI3 Perovskite Polycrystals	44
Selective Tandem CO2-to-C2+ Alcohol Conversion at a Single-Crystal Au/Cu Bimetallic Interface	43
High Internal Phase Emulsion Template Strategy for the Preparation of UiO-66-NH2 Foam Photocatalysts: A Pseudomonas putida Intimately Coupled UiO-66-NH2 System for Efficie	43
Identifying Useful Nanocrystal Morphologies Using Advanced Sampling Techniques and Machine Learning	42
Achieving a Practical High-Voltage Lithium Metal Battery by the Use of a High-Concentration Fluorinated Carbonate Electrolyte	42
Oxygen Reduction Reaction Mechanism in Highly Concentrated Lithium Nitrate-Dimethyl Sulfoxide: Effect of Lithium Nitrate Concentration	42
Thermodynamic and Structural Properties of Bulk and Thin-Film CeVO4 and LaVO4	42
Investigation of SERS Frequency Fluctuations Relevant to Sensing and Catalysis	42
Rational Assembly of the NiMoP/NiCoZn Heterostructure Electrocatalyst for the Hydrogen Evolution Reaction at High Current Densities	41
Pivotal Role of Intersite Hubbard Interactions in Fe-Doped α-MnO2	41
Ab Initio Insights into the Surface Passivation-Driven Moisture Resistance in CsSnI3 Perovskites	40
Electrooxidation of CO on Platinum Nanoparticles Supported on NiO Thin Films	40
An Insight into the Mechanism of Alkyl Side-Chain Engineering of BTCN on Its Photovoltaic Properties─A Theoretical Study	40
Mesoscale Machine Learning Analytics for Electrode Property Estimation	40

Superatom Molecular Orbitals of Li@C60: Effects of the Li Position and the Substrate	40
Efficient Red TADF Emitter and Diode in High Doping Concentration via Steric Hindrance Engineering with Phosphine Oxide	39
Decoupling Chemically Active 2D Molecular Overlayers from the Substrate: Chlorophenyl Porphyrins on Graphene/Ir(111)	39
Deep Learning Models to Identify Common Phases across Material Systems from X-ray Diffraction	39
X-ray Absorption Fine Structure Spectroscopic Interrogation of Catalytic Reaction Kinetics from the Substrate Perspective	39
Defect Engineering through Field-Effect-Induced Sensitization of Surface-Confined Grain Coalescence: A Route to Enhanced Electron Mobility in Li-Doped ZnO	39
Stability and Excitonic Properties of Ag 2 S Single Layer from First-Principles Calculations	39
Role of Functional Thiolated Molecules on the Enhanced Electronic Transport of Interconnected MoS2 Nanostructures	39
Two-Stage Growth for Highly Ordered Epitaxial C60 Films on Au(111)	39
Co-substituted Nonstoichiometric LaMn1–xCoxO3+δ Perovskite Oxide Cathode Catalysts for the Oxygen Reduction Reaction for High-Performance Zn–Air Batterie	38
A Theoretical Approach to Surface Structural Evolution at the Nanoparticle Scale: A Case Study of χ-Fe 5 C 2	38
Lifetime of Photogenerated Positive Charges in Hybrid Cerium Oxide-Based Materials from Space and Mirror Charge Effects in Time-Resolved Photoemission Spectroscopy	38
Controllable Synthesis of Large-Area MoSe2 Monolayer Films and Bilayer Crystals	38
Vanadium Doping Enables Partially Disordered Li-Rich Spinel Cathodes with High Reversible Capacity and Low Migration Barriers	38
Afterglow and Thermally Stimulated Luminescence of Interface-Related States in InP/ZnS Quantum Dots	38
Pressure-Stimulated Photopolymerization in Fullerene Layers of a Molecular Complex [{Zn(Et2dtc)}2·DABCO]·C60·(DABCO)2	38
Self-Similar Plasmonic Nanolenses: Mesoscopic Ensemble Averaging and Chiral Light–Matter Interactions	38
Heterogeneous Engineering of Ni–Co–S Nanosheets for Efficient Urea Electrolysis	38
Graphene-Supported Single-Atom Ni as High-Performance Catalyst for Direct Methane-to-Methanol Conversion	38
Why Do We Have Dual Emission in Two-Dimensional Hybrid Perovskites?	37
Exploration of a New α-T3 System for Electronic Heat Capacity and Pauli Magnetic Susceptibility Properties via the Kane-Mele and Hubbard Model	37
Understanding SERS Spectral Shape Variability through Substrate Optics, Molecular Orientation, and Unsupervised Clustering	37
Mechanistic Insights into the Reductive Amination of 5-HMF to BAMF on the Ni Catalyst and Design of Bimetallic Alloys	37
Inquisitive Optical and Electro-Optical Attributes of Azo-Dye Dispersed Nematic Liquid Crystal for Applications in Wavelength-Tunable Optical Filters	37
DFT-Guided Operando Raman Characterization of Ni-Oxide-Based Phases Relevant to Electrochemical Systems	37
Stacking Effects on the Optoelectronic Properties of 2D Perylene-Zn-Porphyrin-Based COFs	37
Salts Induce Enhanced Disintegration of Natural Minerals in Charged Water Microdroplets	37
Stability of Single-Atom Centers of MXenes under Anodic Polarization Conditions	36
Charge Redistribution in Mg-Doped p-Type MoS2/GaN Photodetectors	36
Efficient Descriptor for Designing High-Performance Cu-Based Catalysts for the Hydrogenation of Dimethyl Oxalate to Methyl Glycolate	36
Understanding Surface Properties in CeO 2 Catalysts for the Synthesis of Dimethyl Carbonate: A Combined In Situ IR and NEXAFS Study	36
Chiroptical Effect in Charge Transfer Processes in Chiral Carbon Dot-Doped Biopolymers: Application Toward Developing Chiral Electrodes	36
Single- and Multilayers of Alkali Metal Atoms inside Graphene/MoS2 Heterostructures: A Systematic First-Principles Study	36
Exploring Superradiance Effects of Molecular Emitters Coupled with Cavity Photons and Plasmon Polaritons: A Perspective from Macroscopic Quantum Electrodynamics	36
Impact of Zn Alloying to CsZnxPb1–xI3 Charge Carrier Diffusion Coefficient, Diffusion Length, and Recombination Parameters	36
Modulated Electronic and Thermal Transport Properties in Cu-Based Diamond-like Chalcogenides by Point Defect Engineering	36
Effect of Crystallinity on Endoergic Singlet Fission in Perylenediimide Single Crystals and Polycrystalline Films	36
In Situ/Operando Spectroscopic Techniques for Nonaqueous Lithium-Based Batteries	35
Resonance-Assisted Hydrogen Bonding Mediated Synergy between Energy and Safety in Energetic Materials: Experimental Inspiration and Mechanism Research	35
Atomistic-Scale Simulations of the High-Temperature Chemistry of Si/C/O/H-Based Polymers and Their Conversion to Si/C Solid Materials	35
Hydrophobic Nanosized H-Beta Catalysis for Biomass Furanic Compound Valorization	35
Effect of the Interfacial Potential on Elementary Exciton Processes in InP-Based Core/Shell Quantum Dots	35
Structure of the Bastnäsite (001) Surface by Crystal Truncation Rod X-ray Diffraction and Ab Initio Molecular Dynamics: Implications for Separations of a Rare Earth Ore Mineral	35
Pr-Doping Effect on Spin Switching in Nd0.8Pr0.2FeO3 Single Crystal	35
Mechanical Properties and Temperature and Pressure Effects on the Crystal Structure of (2S,3S,4R)-2,3,4-(Trinitratomethyl)-1-nitroazetidine (TMNA) by Single-Crystal X-ray Diffractometry and Density Fu	34
Feasibility of Methane Oxidation on SSZ-13 Bridged Pd2Ox Sites: A Theoretical Study	34
Arsenic Oxidation Kinetics with Plasmonic Nanocatalysts	34
Watching Excitations in CsPbBr3 Perovskite Nanocrystals Undergo Ultrafast Relaxation to Their Emitting State	34
Role of Solid–Water Interaction and Film Thickness on Nanoscale Water Evaporation Using Molecular Dynamics	34
Facile Synthesis of Trimetallic Hexoctahedral Au@PdPt Nanoparticles for Electrocatalytic Oxidation of Methanol	34
Composition and Illumination-Driven Phase Segregation in Hybrid Perovskite Cs2AgBi(Br1–xIx)6	34
New Platinum Bimetallic Surfaces, M/Pt(111) and Pt/M/Pt(111) (M = Mo, Zn, and Co), for Furfural Adsorption	34
Distinguishable Separation of Artificial Electron–Oxygen Vacancy Pairs Using Heterovalent Doping Effect for Ferroelectric Photovoltaics	34
Tailoring the Wetting Behavior of Self-Assembled Monolayers by Surface Charge	34
Nonlinear Mechanical Properties of Polymorphic CsPbI3 Perovskite from Reactive Molecular Dynamics Simulations	34
Dynamic Diastereomerism on Chiral Surfaces	34
Electronic Factors Influencing the Thermodynamics of the Oxygen Evolution Reaction in Layered Double Hydroxides with Oxygen Vacancies	34
Size Effects in the Verwey Transition of Nanometer-Thick Micrometer-Wide Magnetite Crystals	33
Identifying Substrate-Dependent Chemical Bonding Nature at Molecule/Metal Interfaces Using Vibrational Sum Frequency Generation Spectroscopy and Theoretical Calculations	33
Te4+-Doping Rubidium Scandium Halide Perovskite Single Crystals Enabling Optical Thermometry	33
Switching the Solid-State Emission of Organic Crystals through Coformer Choice and Vapochromism	33
Electron Coupling between the Linear-Conjugated Polymer Nanocluster and TiO2 Nanoparticle Enables a Quantum Leap for Visible Light-Driven Hydrogen Evolution	33
Molecular Features of Hydration Layers: Insights from Simulation, Microscopy, and Spectroscopy	33
MoS2-Modified CdS Hexagonal Pyramid To Form a New Photogenerated Carrier Migration Path with Highly Efficient Photocatalytic H2 Performance	33
Unveiling the Mechanisms of Photoluminescence Quantum Yield Surge in Cs2AgInCl6 Nanocrystals Triggered by ∼0.8% Bi3+ Doping	33
Determination of the Kinetic Rate Law of Rare-Earth Solvent Extraction Using Interferometry: The Case of Samarium(III)	33
Chemical Vapor Deposition of Pyridinic-Nitrogen-Dominated Graphene Model Electrocatalysts and in Situ Raman Spectroscopic Evidence on Their Active Sites for Oxygen Reduction Reaction	33
Halogen-Regulated Atomically Thin Two-Dimensional Organic–Inorganic Perovskites with Tunable Fluorescence Emission	32
Controlled Growth of a Highly Energetic, Less Electron-Dense Tetrahedral Fe3+ Phase on the Surface of α-Fe2O3 Nanoparticles toward Enhanced Optical, Magnetic, and Supe	32
Microstructure, Transport, and Mechanics of Compacted Clay Simulated at the 0.1 μm Scale (1400 Smectite Clay Particles) Using a Coarse-Grained Model with Explicit Counterions	32
Nonclassical Nucleation of Zinc Oxide from a Physically Motivated Machine-Learning Approach	32
Orthogonal Self-Assembly of Functional Molecules on Surfaces: Theoretical Modeling of Two-in-One Building Blocks	32
Orthorhombic Structures as Inorganic Halide Perovskite Models for High-Throughput DFT Investigations	32
Hydration Accelerates Radiative and Nonradiative Recombination in Small TiO2 Nanoclusters	32
Evolution of the Structural, Topological, and Superconducting Properties of Tellurium under Pressure	32
77Se Solid-State NMR Investigation of Selenium Chemical Shift Tensors of Chalcogen Bonds in Selenadiazole Cocrystals	32
Role of Fluxionality and Metastable Isomers in the ORR Activity: A Case Study	32
Tunable Oxygen Vacancies and Porous Structure of Ta-Doped Tungsten Oxide Films for Enhanced Electrochromic Properties	32
Toward Complete Exfoliation of the Chemisorbed Two-Dimensional Iron Silicates on Ru(0001) via Hydrogenation	32
Temperature-Dependent Optical and Structural Properties of Chiral Two-Dimensional Hybrid Lead-Iodide Perovskites	32

Quantitative Predictions of the Thermal Conductivity in Transition Metal Dichalcogenides: Impact of Point Defects in MoS2 and WS2 Monolayers	32
Deoxygenation-Promoted Aggregation-Induced TADF–RTP Dual Emission for High-Contrast Channel-Selectable Hypoxia Probing	31
Measuring and Enhancing the Ionic Conductivity of Chloroaluminate Electrolytes for Al-Ion Batteries	31
Methanol Synthesis Over PdIn, In2O3, and CuZn From First-Principles Microkinetics: Similarities and Differences	31
Integer Charge Transfer Model–PTCDA on MgO(001)/Ag(001) Probing the Transition from Single to Double Integer Charge Transfer	31
Protonation of Pendant Pyridine Substituents in an Iron Porphyrin Hangman Complex: Influence on Spectral Visibility and Electrocatalysis	31
Pyrrolidinium-Based Organic Cation (BMP)-Intercalated Organic (Coronene) Anode for High-Voltage Dual-Ion Batteries: A Comparative Study with Graphite	31
Modulating Emission of Organic Emitters from Fluorescence to Red Afterglow through Boric Acid-Assisted Energy Transfer	31
Persistent Superconductivity and Enhanced Photovoltaic Effect in YBCO Thin Films under Laser Irradiation	31
Quantum-Mechanically Enhanced Water Flow in Subnanometer Carbon Nanotubes	31
Zero-Valent Iron Inside Carbon Nanocube as an Efficient Peroxymonosulfate Activator toward Catalytic Oxidation of Organic Pollutants	31
Surface Structures of CsSnI3(001) Films on Au(111)	31
Adsorption of NOx Molecules on the Hematite Surface: Isolated Versus Paired	31
Comparative Study of Experiments and Calculations on the Guest Molecules’ Escaping Mechanism of CL-20-Based Host–Guest Energetic Materials	31
How Artificial Intelligence Can Advance Electrochemical Science and Identify Water Molecule Orientation on Platinum Electrodes	31
Issue Editorial Masthead	31
Clean Electrospray Deposition of Porphyrin Molecules and Polyethylene Glycol Chains onto a Au(100) Surface	31
In Situ Neutron Diffraction of Zn-MOF-74 Reveals Nanoconfinement-Induced Effects on Adsorbed Propene	31
Ethanothermal Synthesis of Octahedral-Shaped Doped Mn2O3 Single Crystals as a Precursor for LiMn2O4 Spinel Cathodes in Lithium-Ion Batteries	31
Structure of Water under Confinement in Periodic Mesoporous Organosilicas Investigated by X-ray Scattering	31
Case Study on Exciton-Vibrational Coupling in Molecular Bifluorene Crystals: The Role of Torsional Disorder	31
Hydration and Applied Electric Field Effects on the Structure, Dynamics, and Conductivity of Aqueous Electrolytes at the (104) Calcite Interface	31
Impact of Vanadium Loading and Thermal Aging on the Surface Properties of Titania-Supported Vanadium Oxide	31
Interfacial Charge Transfer and Substrate-Dependent Oxidation States Drive SMSI Enhancements in Cobalt Oxide Films	31
Issue Publication Information	31
Machine Learning-Predicted Ternary Molybdenum Chalcogenophosphides for High-Efficiency Hydrogen Evolution Catalysis	31
Photovoltaic Effect and Photocarrier Dynamics in Mn-Doped BaTiO 3 Ferroelectric Single Crystals	31
Choice of Electrolyte Impacts the Selectivity of Proton-Coupled Electrochemical Reactions on Hydrogen Titanate	30
Structure and Behavior of Oxide-Coated Aluminum in Contact with Acidic and Alkaline Aqueous Solutions─A Reactive Molecular Dynamics Simulation Study	30
Photocatalytic Water Splitting of Al-Doped RhxCr2–xO3/SrTiO3 Synthesized by Flux Method: Elucidating the Role of Different Molten Salts	30
Engineering Nanoparticle Surface Amphiphilicity: An Integrated Computational and Laser Desorption Ionization Study of Controlled Ligand Self-Assembly	30
Energy Transfer for Leaky Surface Plasmon Polaritons in Gold Nanostripes	30
Surface Basic Site Effect on Boron-Promoted Platinum Catalysts for Dry Reforming of Methane	30
A Quantum Virtual Laboratory for Exploring Semiconductor Heterostructures Unlocks the Photocatalytic Destruction Potential of Per- and Polyfluoroalkyl Substances	30
Highly Efficient Triplet–Triplet Annihilation Upconversion with a Thermally Activated Delayed Fluorescence Molecule as Triplet Photosensitizer	30
C═C Bond Hydrogenation vs C–O Bond Hydrogenolysis of Furfuryl Alcohol on Ru: A DFT Study	30
Cross-Linked Gold Nanoparticle Assemblies: What Can We Learn from Single Flat Interfaces?	30
Synthesis and Understanding of the Role of Donor-Tetracyanobutadiene in Porphyrin β-Periphery toward Ultrafast Charge Transfer Dynamics	30
Local Impedance Measurement by Direct Detection of Oscillating Electrostatic Potential Using Kelvin Probe Force Microscopy	30
Raman Mapping as a Tool for Evaluating I2 and I3– Diffusion Over Single-Crystal UiO-67_NH2(M) (M = Zr, Zr/Hf, or Hf)	30
Structural Evolution of Copper-Oxo Sites in Zeolites upon the Reaction with Methane Investigated by Means of Cu K-edge X-ray Absorption Spectroscopy	30
Two-Step Synthesis of Large Gold–Silver Alloy Nanoparticles via the Combination of Seeded Growth and Citrate Co-reduction	30
Probing the Role of Acid Site Distribution on the Water Structure in Aluminosilicate Zeolites: Insights from Molecular Dynamics	30
Surface Organometallic Chemistry as a Versatile Strategy for Synthesizing Supported Bimetallic Cluster Catalysts	29
Spin–Spin Interaction in ε-VOPO4 through Doping Light Elements	29
Ab Initio Thermodynamics of Copper Immunity in Deep Geological Repositories	29
Effect of Ligands and Their Removal on the Au Nanoparticle-Catalyzed Reduction of 4-Nitrophenol	29
Temperature Dependence of Photocatalytic Water Splitting under Visible Light Irradiation over Ir- and Sb-Codoped SrTiO3:Al	29
Surface Plasmon-Coupled Directional Emission Enhanced Raman Scattering Based on Waveguide Coupling Surface Plasmon Resonance Configuration	29
Visualization of Pressure-Induced Phonon–Phonon Mode Coupling and Anharmonicity Analysis in A 3 (VO	29
Atomistic Theory of Hot-Carrier Relaxation in Large Plasmonic Nanoparticles	29
IR Spectroscopy of Carboxylate-Passivated Semiconducting Nanocrystals: Simulation and Experiment	29
Ab Initio Insights into Charge Localization in Bismuth Oxyhalides BiOX (X = F, Cl, Br, I)	29
Hole-Dominated Altermagnetic RuO2 Thin Films Prepared by Reactive Sputtering	29
Photoexcited Ultrafast Order–Disorder Dynamics in Monolayer SnSe: Dominant Role of Anharmonic Phonon Modes	29
Entropy Effects on Reactive Processes at Metal-Solvent Interfaces	29
Predicting Interfacial Thermal Conductance and Thermal Conductivity across Multilayer TiS2/MoS2 van der Waals Heterostructures Using Moment Tensor Potentials	29
Hydrogen-Atom-Assisted Tautomerization on Solid Surfaces─The Case Study of Thioacetamide	28
Effect of Ions on the Aqueous-Phase Adsorption of Small Aromatic Organics on Silver	28
Infrared and Raman Diagnostic Modeling of Phosphate Adsorption on Ceria Nanoparticles	28
Electrochemical Current Amplification of Bisphenol A in the Presence of Magnetite Nanoparticles	28
Charge Transfer in the P(g42T-T):BBL Organic Polymer Heterojunction Measured with Core-Hole Clock Spectroscopy	28
Novel Tri-rutile Ni0.5Ti0.5TaO4 Microwave Dielectric Ceramics: Crystal Structure Chemistry, Raman Vibration Mode, and Chemical Bond Characteristic In-Depth Studies	28
Descriptor-Driven Prediction of Adsorption Energy of Oxygenates on Metal Dioxide Surfaces	28
Role of Water Solvation on the Key Intermediates Catalyzing Oxygen Evolution on RuO2	28
Unusual Photophysical Properties of Porphyrin-Based Supramolecular Polymers Unveiled: The Role of Metal Ligands and Side Group Amide Connectivity	28
Enhanced Stability and Catalytic Performance of Iron–Manganese Dual-Atoms Supported on Graphene Edges for Oxygen Reduction Reaction	28
Quantum Chemical Investigation of the Interaction of Sodium Ions with Hard Carbon-Based Systems	28
On the Origin of Ion Intercalation and Conductivity Enhancement in Sn-Doped V2O5 Cathodes of Li-Ion Batteries: A Computational Study	28
Disentangling Chemical Interaction and Electric Fields at Electrochemical Interfaces	28
Bond-Valence-Sum-Modified 3d Ionic Electronegativity in LaMO 3 (M = Sc - Ni) Perovskite Oxides	28
Structural Characterization of Mn3O4(001) Thin Films and Their Interaction with CO	28
Efficient Photocatalytic CO 2 Reduction to Syngas with Tunable Ratios Enabled by an S-Scheme TiO 2	28
Computational Insights into Two-Dimensional M3(HHTP)2 Metal–Organic Frameworks as ORR/OER Electrocatalysts	28
Optical Properties of Two-Dimensional Organic–Inorganic Perovskite Material (C 12 H 25 NH	28
Revealing the Dynamic Evolution and Reactivity of Oxygen Species over Cu-Exchanged Zeolites: Insights from In Situ Multiwavelength Raman Spectroscopy	28
Optimizing the Atom Substitution of Er in WS2 Nanosheets for High-Performance Photoelectrochemical Applications	28
Atomic Pathways of Ammonia-Driven Fe 3 O 4 Reduction Revealed by First-Principles Calculations	27
Corrosion of Electrochemical Energy Materials: Stability Analyses Beyond Pourbaix Diagrams	27
Surface Coverage as an Important Parameter for Predicting Selectivity Trends in Electrochemical CO2 Reduction	27
Multilayer Coaxial TiO2/BaTiO3/WO3 Nanorod Arrays with Enhanced Photoelectrochemical Properties under the Ferroelectric Polarization Effect	27
Visible-Light-Driven Desulfurization Reaction Using Partially Oxidized TiN Nanoparticles as Photocatalysts	27
Machine Learning, Density Functional Theory, and Experiments to Understand the Photocatalytic Reduction of CO2 on CuPt/TiO2	27
Optimizing Electronic Interactions in Terbium–Dysprosium-Codoped Calcium Fluoride Nanoparticles to Enhance Near-Monochromatic Green and Generate Broadband Yellow Emission	27
Electronic Properties of Graphynes Based on a 4, 6, 12-Archimedean Tiling	27
Flow Assurance of Hydrate Risk in Natural Gas/Oil Transportation: State-of-the-Art and Future Challenges	27
Low Conductivity Polyaniline–Gold Nanocomposite via Interfacial Polymerization: Efficient Humidity Sensing by Thin Films and Mechanistic Insights through In Situ Experiments	27
On the Local Structure in Ordered and Disordered Closo-hydroborate Solid Electrolytes	27
Multi-level Descriptor Construction for Screening Eligible Single-Atom-Embedded Ternary B3C2P3 Monolayers as Nitrogen Fixation Catalysts	27
A Study on the Structure, Electronic Structure, and Mechanical Properties of Three ZrO2/CeO2 Interfaces	27
Optical Characterizations for Broadening Emissions from Doping of the Two-Dimensional Tin–Lead Perovskite Films	27
Radiative and Non-Radiative Exciton Recombination Processes in a Chemical Vapor Deposition-Grown MoSe2 Film	27
Coupling Dichroism in Strong-Coupled Chiral Molecule-Plasmon Nanoparticle System	27
Structure–Property Correlations in Aqueous Binary Na+/K+–CH3COO– Highly Concentrated Electrolytes	27
Highly Tunable Photoluminescence of Wide-Bandgap Lead-Chloride Perovskite Single Crystal Based on Ion Beam Irradiation	27