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	374
Phase Transition and Mechanical Properties of Scandium Diboride under High Pressure	116
Phase Evolution, Structural Transformations, and Reaction Kinetics during Mechanochemical Formation of NaFeF3 from Binary Fluorides	107
Ligand Substitutional Effects on Molecular Dynamics and Broadband Near-White Emission in 2D 2-Fluoroethylammonium Cadmium Chlorobromide	98
Robust Ohmic Contact in Monolayer ZrI2 Coupled with Cold Metal	82
Bromination-Enhanced Chiral Interactions for Triphenylamine on Au and Ag(111)	78
Nature of Spin-Glass Behavior of Cobalt-Doped Iron Disulfide Nanospheres Using the Monte Carlo Method	77
Magnetostructural Correlations in a Layered Perovskite: K2CuF4 at Large Compression	74
Thermal Stability of Ionic Compounds on Nanostructured Metal Catalysts: Conversion of Quaternary Ammonium to Amines on Gold Nanoparticles	74
Type II Germanium Clathrates from Zintl Phase Precursor Na4Ge4: Understanding Desodiation Processes and Sodium Migration Using First-Principles Calculations	71
Crowding-Out Effect in Synergistic C–C Coupling on PdNi Alloy Nanoparticles Studied by Surface-Enhanced Raman Spectroscopy	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	67
Theoretical Prediction and High-Pressure Synthesis of New LISICON-Type Solid-State Electrolyte Li2.75[B0.625P0.125S0.25]O3.375	66
Direct Visualization of Aluminum Particle Wetting on Carbon Using In Situ Laser Heating TEM	64
Tuning Preferential Molecular Adsorption and Self-Assembled Molecular Network Formation at the Liquid–Solid Interface: The Impact of Annealing and Confinement	61
Growth and Electronic Properties of SnSe2 Films on Reconstructed, (111)-Oriented SrTiO3 Substrates	61
Issue Editorial Masthead	59
Computational Insight into Selective Hydrogenolysis over Monomeric MoOx-Modified Rh Catalysts in the Aqueous Phase	59
Surface Energies of LaMnO3 High-Index Surfaces Obtained from Density-Functional Theory	59
Vacancy-Driven Sizable Shift Current in Centrosymmetric Materials	59
Vibration Promotes Mass Transfer of Products in Photoelectrochemical Water Splitting by Enhancing Forced Convection	59
On-Surface Synthesis of Three-Dimensional Graphene Nanoribbons via a [2 + 2] Cycloaddition Reaction and Their Planarization	58

Charge Transfer Dynamics of Core–Shell Quantum Dots and MoS2 Nanocomposites Using Transient Absorption Spectroscopy	58
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Depolarization via Coherently Activated Plasmonic Metasurfaces	57
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Issue Editorial Masthead	56
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Issue Editorial Masthead	55
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Issue Editorial Masthead	51
Mechanism Exploration of Black Phosphorus Quantum Dots for Hydrogen Peroxide Modulation in Tumor Microenvironments	51
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Emergence of New Nitrogen-Rich Compounds in Lead–Nitrogen Phase Diagram Under Pressure	51
Experimental Analysis of the Elastic Moduli of Atomically Thin Transition Metal Dichalcogenides	50
The Roles of Oxygen Vacancies in Boosting Oxygen Evolution Reaction over Perovskite CeFeO 3−δ /NF Catalysts: An Experimental and Theoretical Investig	49
Direct Laser Patterning of Polymeric Structures Containing Gold Nanoparticles and Demonstration of Its Nonlinear Optical Effect	49
Waveguide-Based Spectroelectrochemical Characterization of Band Edge Energies in Submonolayers of CdSe Quantum Dots Tethered to Indium–Tin Oxide Electrodes	48
Screening of Ionic Liquid-Based Electrolytes for Al Dual-Ion Batteries: Thermodynamic Cycle and Combined MD-DFT Approaches	48
On-Surface Alcohol Formation from a Carbene Precursor	48
Impact of Polarization Effect on Exciton Binding Energies and Charge Transport for the Crystals of Chlorinated ITIC Derivatives	47
Correction to “Surface Plasmon-Coupled Directional Emission Enhanced Raman Scattering Based on Waveguide Coupling Surface Plasmon Resonance Configuration”	47
First-Principles Study of O2 Activation over Pd Adclusters and Embedded Clusters in Pd–Au Bimetallic Surfaces	47
Cellulose Nanofibers Impart Melt Resistance to Ice through Optical and Thermal Mechanisms	47
Stability and Diffusion of Oxygen Vacancies in LaNiO 3 : A DMFT Study	46
Correction to “Energies of Formation Reactions Measured for Adsorbates on Late Transition Metal Surfaces”	46
Metal–Support Electronic Coupling in Re 2 /NiO Enables Early N≡N Bond Cleavage and Dissociative N 2	46
Toward Instant Prediction of Metal Adatom Diffusion Barriers for Understanding of Sintering and Catalyst Durability	46
Mechanism of Solvent Engineering for Controlling the Room-Temperature Crystallization Kinetics of MAPbI3 Perovskite Polycrystals	45
Pseudohalide Anion Surface Engineering for Mixed Cation Perovskite Nanocrystals	45
Selective Tandem CO2-to-C2+ Alcohol Conversion at a Single-Crystal Au/Cu Bimetallic Interface	44
Identifying Useful Nanocrystal Morphologies Using Advanced Sampling Techniques and Machine Learning	44
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	44
Thermodynamic and Structural Properties of Bulk and Thin-Film CeVO4 and LaVO4	43
Electrooxidation of CO on Platinum Nanoparticles Supported on NiO Thin Films	43
Investigation of SERS Frequency Fluctuations Relevant to Sensing and Catalysis	43
Achieving a Practical High-Voltage Lithium Metal Battery by the Use of a High-Concentration Fluorinated Carbonate Electrolyte	43
Ab Initio Insights into the Surface Passivation-Driven Moisture Resistance in CsSnI3 Perovskites	42
Mesoscale Machine Learning Analytics for Electrode Property Estimation	42
Superatom Molecular Orbitals of Li@C60: Effects of the Li Position and the Substrate	42
An Insight into the Mechanism of Alkyl Side-Chain Engineering of BTCN on Its Photovoltaic Properties─A Theoretical Study	42
Stability and Excitonic Properties of Ag 2 S Single Layer from First-Principles Calculations	42
X-ray Absorption Fine Structure Spectroscopic Interrogation of Catalytic Reaction Kinetics from the Substrate Perspective	41
Efficient Red TADF Emitter and Diode in High Doping Concentration via Steric Hindrance Engineering with Phosphine Oxide	41
Lifetime of Photogenerated Positive Charges in Hybrid Cerium Oxide-Based Materials from Space and Mirror Charge Effects in Time-Resolved Photoemission Spectroscopy	40
Graphene-Supported Single-Atom Ni as High-Performance Catalyst for Direct Methane-to-Methanol Conversion	40
Decoupling Chemically Active 2D Molecular Overlayers from the Substrate: Chlorophenyl Porphyrins on Graphene/Ir(111)	40
Pressure-Stimulated Photopolymerization in Fullerene Layers of a Molecular Complex [{Zn(Et2dtc)}2·DABCO]·C60·(DABCO)2	40
Role of Functional Thiolated Molecules on the Enhanced Electronic Transport of Interconnected MoS2 Nanostructures	40

Co-substituted Nonstoichiometric LaMn1–xCoxO3+δ Perovskite Oxide Cathode Catalysts for the Oxygen Reduction Reaction for High-Performance Zn–Air Batterie	39
A Theoretical Approach to Surface Structural Evolution at the Nanoparticle Scale: A Case Study of χ-Fe 5 C 2	39
Vanadium Doping Enables Partially Disordered Li-Rich Spinel Cathodes with High Reversible Capacity and Low Migration Barriers	39
Why Do We Have Dual Emission in Two-Dimensional Hybrid Perovskites?	39
Controllable Synthesis of Large-Area MoSe2 Monolayer Films and Bilayer Crystals	39
Afterglow and Thermally Stimulated Luminescence of Interface-Related States in InP/ZnS Quantum Dots	39
Heterogeneous Engineering of Ni–Co–S Nanosheets for Efficient Urea Electrolysis	39
Salts Induce Enhanced Disintegration of Natural Minerals in Charged Water Microdroplets	38
Effect of Crystallinity on Endoergic Singlet Fission in Perylenediimide Single Crystals and Polycrystalline Films	38
Mechanistic Insights into the Reductive Amination of 5-HMF to BAMF on the Ni Catalyst and Design of Bimetallic Alloys	38
Charge Redistribution in Mg-Doped p-Type MoS2/GaN Photodetectors	38
Effect of the Interfacial Potential on Elementary Exciton Processes in InP-Based Core/Shell Quantum Dots	38
Exploration of a New α-T3 System for Electronic Heat Capacity and Pauli Magnetic Susceptibility Properties via the Kane-Mele and Hubbard Model	38
Exploring Superradiance Effects of Molecular Emitters Coupled with Cavity Photons and Plasmon Polaritons: A Perspective from Macroscopic Quantum Electrodynamics	38
Chiroptical Effect in Charge Transfer Processes in Chiral Carbon Dot-Doped Biopolymers: Application Toward Developing Chiral Electrodes	38
Modulated Electronic and Thermal Transport Properties in Cu-Based Diamond-like Chalcogenides by Point Defect Engineering	38
Stacking Effects on the Optoelectronic Properties of 2D Perylene-Zn-Porphyrin-Based COFs	38
Efficient Descriptor for Designing High-Performance Cu-Based Catalysts for the Hydrogenation of Dimethyl Oxalate to Methyl Glycolate	38
Single- and Multilayers of Alkali Metal Atoms inside Graphene/MoS2 Heterostructures: A Systematic First-Principles Study	38
Stability of Single-Atom Centers of MXenes under Anodic Polarization Conditions	38
Composition and Illumination-Driven Phase Segregation in Hybrid Perovskite Cs2AgBi(Br1–xIx)6	37
New Platinum Bimetallic Surfaces, M/Pt(111) and Pt/M/Pt(111) (M = Mo, Zn, and Co), for Furfural Adsorption	37
Atomistic-Scale Simulations of the High-Temperature Chemistry of Si/C/O/H-Based Polymers and Their Conversion to Si/C Solid Materials	37
Pr-Doping Effect on Spin Switching in Nd0.8Pr0.2FeO3 Single Crystal	37
Nonlinear Mechanical Properties of Polymorphic CsPbI3 Perovskite from Reactive Molecular Dynamics Simulations	37
Hydrophobic Nanosized H-Beta Catalysis for Biomass Furanic Compound Valorization	37
Arsenic Oxidation Kinetics with Plasmonic Nanocatalysts	37
Dynamic Diastereomerism on Chiral Surfaces	37
Feasibility of Methane Oxidation on SSZ-13 Bridged Pd2Ox Sites: A Theoretical Study	37
Tailoring the Wetting Behavior of Self-Assembled Monolayers by Surface Charge	36
Distinguishable Separation of Artificial Electron–Oxygen Vacancy Pairs Using Heterovalent Doping Effect for Ferroelectric Photovoltaics	36
Facile Synthesis of Trimetallic Hexoctahedral Au@PdPt Nanoparticles for Electrocatalytic Oxidation of Methanol	36
Role of Solid–Water Interaction and Film Thickness on Nanoscale Water Evaporation Using Molecular Dynamics	36
Watching Excitations in CsPbBr3 Perovskite Nanocrystals Undergo Ultrafast Relaxation to Their Emitting State	36
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	36
Electronic Factors Influencing the Thermodynamics of the Oxygen Evolution Reaction in Layered Double Hydroxides with Oxygen Vacancies	36
Unveiling the Mechanisms of Photoluminescence Quantum Yield Surge in Cs2AgInCl6 Nanocrystals Triggered by ∼0.8% Bi3+ Doping	35
Chemical Vapor Deposition of Pyridinic-Nitrogen-Dominated Graphene Model Electrocatalysts and in Situ Raman Spectroscopic Evidence on Their Active Sites for Oxygen Reduction Reaction	35
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	35
Orthorhombic Structures as Inorganic Halide Perovskite Models for High-Throughput DFT Investigations	35
Size Effects in the Verwey Transition of Nanometer-Thick Micrometer-Wide Magnetite Crystals	35
Determination of the Kinetic Rate Law of Rare-Earth Solvent Extraction Using Interferometry: The Case of Samarium(III)	35
Role of Fluxionality and Metastable Isomers in the ORR Activity: A Case Study	35
Identifying Substrate-Dependent Chemical Bonding Nature at Molecule/Metal Interfaces Using Vibrational Sum Frequency Generation Spectroscopy and Theoretical Calculations	35
Electron Coupling between the Linear-Conjugated Polymer Nanocluster and TiO2 Nanoparticle Enables a Quantum Leap for Visible Light-Driven Hydrogen Evolution	35
Orthogonal Self-Assembly of Functional Molecules on Surfaces: Theoretical Modeling of Two-in-One Building Blocks	35
Quantitative Predictions of the Thermal Conductivity in Transition Metal Dichalcogenides: Impact of Point Defects in MoS2 and WS2 Monolayers	34
Temperature-Dependent Optical and Structural Properties of Chiral Two-Dimensional Hybrid Lead-Iodide Perovskites	34
Surface Structures of CsSnI3(001) Films on Au(111)	34
Highly Efficient CO Oxidation on Atomically Thin Pt Plates Supported on Irreducible Si 7 × 7	34
Hydration Accelerates Radiative and Nonradiative Recombination in Small TiO2 Nanoclusters	34
Evolution of the Structural, Topological, and Superconducting Properties of Tellurium under Pressure	34
Hydration and Applied Electric Field Effects on the Structure, Dynamics, and Conductivity of Aqueous Electrolytes at the (104) Calcite Interface	34
Impact of Vanadium Loading and Thermal Aging on the Surface Properties of Titania-Supported Vanadium Oxide	34
Additivity of Atomic Strain Fields as a Tool to Strain-Engineering Phase-Stabilized CsPbI3 Perovskites	34
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	34
Halogen-Regulated Atomically Thin Two-Dimensional Organic–Inorganic Perovskites with Tunable Fluorescence Emission	34
Facet-Dependent Catalytic Selectivity for Electrochemical Reduction of CO on Copper	34
State of the Surface During CO Hydrogenation over Ni(111) and Ni(211) Probed by Operando X-ray Photoelectron Spectroscopy	34
Measuring and Enhancing the Ionic Conductivity of Chloroaluminate Electrolytes for Al-Ion Batteries	34
Toward Complete Exfoliation of the Chemisorbed Two-Dimensional Iron Silicates on Ru(0001) via Hydrogenation	34
Polymorphous meso-Dicyanovinyl-Substituted Tetraphenylethylene Derivative Showing Distinguishing Two-Color Emission and Ultrahigh-Contrast Mechano-Responsive Luminescence Behavior	33
Formation of BN-Networks from BN-HBP on Copper Substrates	33
Low Conductivity Polyaniline–Gold Nanocomposite via Interfacial Polymerization: Efficient Humidity Sensing by Thin Films and Mechanistic Insights through In Situ Experiments	33
Modeling of Close-Packed Patterns of Intact and Partially Deprotonated TPTC Molecules	33
Radiative and Non-Radiative Exciton Recombination Processes in a Chemical Vapor Deposition-Grown MoSe2 Film	33
Femtosecond Laser-Induced Desorption of Hydrogen Molecules from Ru(0001): A Systematic Study Based on Machine-Learned Potentials	33
Toward an Improved Method for Determining the Hamaker Constant of Solid Materials Using Atomic Force Microscopy. III: Experimental Validation of a New Approach-to-Contact Method	33
Optical Characterizations for Broadening Emissions from Doping of the Two-Dimensional Tin–Lead Perovskite Films	33
Structure–Property Correlations in Aqueous Binary Na+/K+–CH3COO– Highly Concentrated Electrolytes	32
Electrospun CuO–Fe3O4 Tube Catalyst for the Decomposition of Organic Matter via an Accelerated Heterogeneous Fenton-like Process	32
Disentangling Chemical Interaction and Electric Fields at Electrochemical Interfaces	32
Effect of Ions on the Aqueous-Phase Adsorption of Small Aromatic Organics on Silver	32
Highly Tunable Photoluminescence of Wide-Bandgap Lead-Chloride Perovskite Single Crystal Based on Ion Beam Irradiation	32
Coupling Dichroism in Strong-Coupled Chiral Molecule-Plasmon Nanoparticle System	32
In Situ Evaluation of Perovskite Solar Cells after 8 MeV Proton Irradiation at Low Temperatures	32
Hydrogen-Atom-Assisted Tautomerization on Solid Surfaces─The Case Study of Thioacetamide	32
Unusual Photophysical Properties of Porphyrin-Based Supramolecular Polymers Unveiled: The Role of Metal Ligands and Side Group Amide Connectivity	32
Multi-level Descriptor Construction for Screening Eligible Single-Atom-Embedded Ternary B3C2P3 Monolayers as Nitrogen Fixation Catalysts	32
Visible-Light-Driven Desulfurization Reaction Using Partially Oxidized TiN Nanoparticles as Photocatalysts	32

Multilayer Coaxial TiO2/BaTiO3/WO3 Nanorod Arrays with Enhanced Photoelectrochemical Properties under the Ferroelectric Polarization Effect	32
Structural Characterization of Mn3O4(001) Thin Films and Their Interaction with CO	32
Novel Tri-rutile Ni0.5Ti0.5TaO4 Microwave Dielectric Ceramics: Crystal Structure Chemistry, Raman Vibration Mode, and Chemical Bond Characteristic In-Depth Studies	32
Efficient Photocatalytic CO 2 Reduction to Syngas with Tunable Ratios Enabled by an S-Scheme TiO 2	31
In Situ/Operando Spectroscopic Techniques for Nonaqueous Lithium-Based Batteries	31
Comment on “Orthorhombic Symmetry and Anisotropic Properties of Rutile TiO2”	31
Optimizing Electronic Interactions in Terbium–Dysprosium-Codoped Calcium Fluoride Nanoparticles to Enhance Near-Monochromatic Green and Generate Broadband Yellow Emission	31
Quantum Chemical Investigation of the Interaction of Sodium Ions with Hard Carbon-Based Systems	31
Electrochemical Current Amplification of Bisphenol A in the Presence of Magnetite Nanoparticles	31
Revealing the Dynamic Evolution and Reactivity of Oxygen Species over Cu-Exchanged Zeolites: Insights from In Situ Multiwavelength Raman Spectroscopy	31
The hBN Defects Database: A Theoretical Compilation of Color Centers in Hexagonal Boron Nitride	31
Atomic Pathways of Ammonia-Driven Fe 3 O 4 Reduction Revealed by First-Principles Calculations	31
Enhanced Stability and Catalytic Performance of Iron–Manganese Dual-Atoms Supported on Graphene Edges for Oxygen Reduction Reaction	31
Optical Properties of Two-Dimensional Organic–Inorganic Perovskite Material (C 12 H 25 NH	31
Bond-Valence-Sum-Modified 3d Ionic Electronegativity in LaMO 3 (M = Sc - Ni) Perovskite Oxides	31
Engineering Nanoparticle Surface Amphiphilicity: An Integrated Computational and Laser Desorption Ionization Study of Controlled Ligand Self-Assembly	31
Adsorption of NOx Molecules on the Hematite Surface: Isolated Versus Paired	31
Corrosion of Electrochemical Energy Materials: Stability Analyses Beyond Pourbaix Diagrams	31
Electronic Properties of Graphynes Based on a 4, 6, 12-Archimedean Tiling	31
Charge Transfer in the P(g42T-T):BBL Organic Polymer Heterojunction Measured with Core-Hole Clock Spectroscopy	31
Deoxygenation-Promoted Aggregation-Induced TADF–RTP Dual Emission for High-Contrast Channel-Selectable Hypoxia Probing	30
Protonation of Pendant Pyridine Substituents in an Iron Porphyrin Hangman Complex: Influence on Spectral Visibility and Electrocatalysis	30
Issue Editorial Masthead	30
Clean Electrospray Deposition of Porphyrin Molecules and Polyethylene Glycol Chains onto a Au(100) Surface	30
In Situ Neutron Diffraction of Zn-MOF-74 Reveals Nanoconfinement-Induced Effects on Adsorbed Propene	30
Photovoltaic Effect and Photocarrier Dynamics in Mn-Doped BaTiO 3 Ferroelectric Single Crystals	30
Structure of Water under Confinement in Periodic Mesoporous Organosilicas Investigated by X-ray Scattering	30
Ethanothermal Synthesis of Octahedral-Shaped Doped Mn2O3 Single Crystals as a Precursor for LiMn2O4 Spinel Cathodes in Lithium-Ion Batteries	30
Issue Publication Information	30
Machine Learning-Predicted Ternary Molybdenum Chalcogenophosphides for High-Efficiency Hydrogen Evolution Catalysis	30
Interfacial Charge Transfer and Substrate-Dependent Oxidation States Drive SMSI Enhancements in Cobalt Oxide Films	30
Case Study on Exciton-Vibrational Coupling in Molecular Bifluorene Crystals: The Role of Torsional Disorder	30
Comparative Study of Experiments and Calculations on the Guest Molecules’ Escaping Mechanism of CL-20-Based Host–Guest Energetic Materials	30
How Artificial Intelligence Can Advance Electrochemical Science and Identify Water Molecule Orientation on Platinum Electrodes	30
Modulating Emission of Organic Emitters from Fluorescence to Red Afterglow through Boric Acid-Assisted Energy Transfer	30
Persistent Superconductivity and Enhanced Photovoltaic Effect in YBCO Thin Films under Laser Irradiation	30
Visualization of Pressure-Induced Phonon–Phonon Mode Coupling and Anharmonicity Analysis in A 3 (VO	29
Energy Transfer for Leaky Surface Plasmon Polaritons in Gold Nanostripes	29
Photocatalytic Water Splitting of Al-Doped RhxCr2–xO3/SrTiO3 Synthesized by Flux Method: Elucidating the Role of Different Molten Salts	29
Raman Mapping as a Tool for Evaluating I2 and I3– Diffusion Over Single-Crystal UiO-67_NH2(M) (M = Zr, Zr/Hf, or Hf)	29
Ab Initio Insights into Charge Localization in Bismuth Oxyhalides BiOX (X = F, Cl, Br, I)	29
Spin–Spin Interaction in ε-VOPO4 through Doping Light Elements	29
Ab Initio Thermodynamics of Copper Immunity in Deep Geological Repositories	29
Choice of Electrolyte Impacts the Selectivity of Proton-Coupled Electrochemical Reactions on Hydrogen Titanate	29
Two-Step Synthesis of Large Gold–Silver Alloy Nanoparticles via the Combination of Seeded Growth and Citrate Co-reduction	29
Quantum-Mechanically Enhanced Water Flow in Subnanometer Carbon Nanotubes	29
Local Impedance Measurement by Direct Detection of Oscillating Electrostatic Potential Using Kelvin Probe Force Microscopy	29
Surface Plasmon-Coupled Directional Emission Enhanced Raman Scattering Based on Waveguide Coupling Surface Plasmon Resonance Configuration	29
Photoexcited Ultrafast Order–Disorder Dynamics in Monolayer SnSe: Dominant Role of Anharmonic Phonon Modes	29
Highly Efficient Triplet–Triplet Annihilation Upconversion with a Thermally Activated Delayed Fluorescence Molecule as Triplet Photosensitizer	29
A Quantum Virtual Laboratory for Exploring Semiconductor Heterostructures Unlocks the Photocatalytic Destruction Potential of Per- and Polyfluoroalkyl Substances	29
C═C Bond Hydrogenation vs C–O Bond Hydrogenolysis of Furfuryl Alcohol on Ru: A DFT Study	29
Surface Organometallic Chemistry as a Versatile Strategy for Synthesizing Supported Bimetallic Cluster Catalysts	29
Hole-Dominated Altermagnetic RuO2 Thin Films Prepared by Reactive Sputtering	29
Switching the Solid-State Emission of Organic Crystals through Coformer Choice and Vapochromism	28
Stability and Phase Transformations in Au–Pd Nanoparticles Studied by Means of Combined Monte Carlo and Molecular Dynamics Simulations	28
Inquisitive Optical and Electro-Optical Attributes of Azo-Dye Dispersed Nematic Liquid Crystal for Applications in Wavelength-Tunable Optical Filters	28
Low-Temperature Electron Spin Resonance Study of MnPS3 Antiferromagnetic Single Crystal	28
Infrared and Raman Diagnostic Modeling of Phosphate Adsorption on Ceria Nanoparticles	28
Role of Water Solvation on the Key Intermediates Catalyzing Oxygen Evolution on RuO2	28
IR Spectroscopy of Carboxylate-Passivated Semiconducting Nanocrystals: Simulation and Experiment	28
Grand Canonical DFT Investigation of the CO2RR and HER Reaction Mechanisms on MoTe2 Edges	28
Stability of Iridium Single Atoms on Fe3O4(001) in the mbar Pressure Range	28
Defect Engineering through Field-Effect-Induced Sensitization of Surface-Confined Grain Coalescence: A Route to Enhanced Electron Mobility in Li-Doped ZnO	28
Two-Stage Growth for Highly Ordered Epitaxial C60 Films on Au(111)	28
Integer Charge Transfer Model–PTCDA on MgO(001)/Ag(001) Probing the Transition from Single to Double Integer Charge Transfer	28
Predicting Interfacial Thermal Conductance and Thermal Conductivity across Multilayer TiS2/MoS2 van der Waals Heterostructures Using Moment Tensor Potentials	28
Te4+-Doping Rubidium Scandium Halide Perovskite Single Crystals Enabling Optical Thermometry	28
Entropy Effects on Reactive Processes at Metal-Solvent Interfaces	28
Deep Learning Models to Identify Common Phases across Material Systems from X-ray Diffraction	28
Elucidation of a Metastable p(2 × 1) O Atom Adlayer Structure on Cu(111)	28
Ion Dynamics and Nanostructures of Diluted Ionic Liquid Electrolytes	28
Understanding Surface Properties in CeO 2 Catalysts for the Synthesis of Dimethyl Carbonate: A Combined In Situ IR and NEXAFS Study	28
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	27
Ultrasensitive Refractive Index Sensing Based on Hybrid High-Q Metasurfaces	27
Probing the Role of Acid Site Distribution on the Water Structure in Aluminosilicate Zeolites: Insights from Molecular Dynamics	27
Flow Assurance of Hydrate Risk in Natural Gas/Oil Transportation: State-of-the-Art and Future Challenges	27
Impact of Nanostructurization of the Pore Walls on the Dynamics of a Series of Phenyl Alcohols Incorporated within Nanoporous Aluminum Oxide Templates	27
Cross-Linked Gold Nanoparticle Assemblies: What Can We Learn from Single Flat Interfaces?	27
Zero-Valent Iron Inside Carbon Nanocube as an Efficient Peroxymonosulfate Activator toward Catalytic Oxidation of Organic Pollutants	27
Computational Insights into Two-Dimensional M3(HHTP)2 Metal–Organic Frameworks as ORR/OER Electrocatalysts	27
Self-Similar Plasmonic Nanolenses: Mesoscopic Ensemble Averaging and Chiral Light–Matter Interactions	27
Role of Electrode Polarization in the Electron Transport Chirality-Induced Spin-Selectivity Effect	27
Band-like Optical Signatures of Ti 3 C 2 T x	27
Rational Assembly of the NiMoP/NiCoZn Heterostructure Electrocatalyst for the Hydrogen Evolution Reaction at High Current Densities	27
77Se Solid-State NMR Investigation of Selenium Chemical Shift Tensors of Chalcogen Bonds in Selenadiazole Cocrystals	27
Pivotal Role of Intersite Hubbard Interactions in Fe-Doped α-MnO2	27
A Study on the Structure, Electronic Structure, and Mechanical Properties of Three ZrO2/CeO2 Interfaces	27
Tunable Oxygen Vacancies and Porous Structure of Ta-Doped Tungsten Oxide Films for Enhanced Electrochromic Properties	27
Oxygen Reduction Reaction Mechanism in Highly Concentrated Lithium Nitrate-Dimethyl Sulfoxide: Effect of Lithium Nitrate Concentration	27
Band Offsets at β/γ-Ga 2 O 3 Interface: A Comprehensive Ab Initio and Experimental Investigation	27
Surface Basic Site Effect on Boron-Promoted Platinum Catalysts for Dry Reforming of Methane	27
NiVCl 2 Monolayer: A Robust Topological Nodal Loop Semimetal with a High Curie Temperature	27
Improved Photocatalytic O2 Evolution on a Sillén–Aurivillius Perovskite Oxychloride Bi6NbWO14Cl by Rh2O3 Additives and Surface Modifications	26
Role of Fe–C–Al Sites for Low-Temperature CO Oxidation (∼50 °C) over the Fe-Oxide Nanoparticles Supported by Al2O3	26