ChemPhysChem

Article	Citations
The Bond Energy of the Carbon Skeleton in Polyaromatic Halohydrocarbon Molecules	114
Cover Feature: Deciphering Mg‐Surface Interactions with Unsaturated Hydrocarbons: An Integrated Experimental‐Theoretical Study (ChemPhysChem 7/2025)	105
Excited State Assignment and State‐Resolved Photoelectron Circular Dichroism in Chalcogen‐Substituted Fenchones	84
Exploring the Reaction Mechanism of Methanol Steam Reforming on CuZn 3 O 3 Cluster: A Density Func	55
Bioinspired Hybrid Polymeric Microspheres with Fractionated Lignin: Advanced Sorbents for Tetracycline Removal from Aqueous Media	46
The Steady‐State ALTADENA RASER Generates Continuous NMR Signals	40
	39
An Algebraic Blueprint for Predicting Turnover Numbers and Endpoints in Photocatalysis	38
Cover Feature: Increasing Complexity in Adamantyl Thioethers Characterized by Rotational Spectroscopy (ChemPhysChem 23/2023)	37
Elucidating the Mechanism of Simultaneous Activation of CH4 and CO2 Mediated by Single Group 10 Metal Anions in Gas Phase	36
Cover Feature: Energetics of Sulfur‐Carbon Interaction (ChemPhysChem 24/2022)	35
Coadsorption of ZnTPP and 2HMCTPP on Rutile TiO2(110)	34
Front Cover: An Algebraic Blueprint for Predicting Turnover Numbers and Endpoints in Photocatalysis (ChemPhysChem 3/2024)	32
Substituent Effect of Superhalogens on the Metallodrug IMeAuCl: A DFT Study	31
Thermal Isomerization Rates of New Azoquinoline‐Functionalized Copolymers as a Function of Substitution Patterns	31
Cover Feature: Overcoming Challenges in Density Functional Theory‐Based Calculations of Hyperfine Coupling Constants for Heavy Heteroatom Radicals (ChemPhysChem 10/2025)	30
Cover Feature: Rare Spin Avoided σ‐σ Diradical Planar Tetracoordinate Boron Cluster: A Proto‐Star for Planar Pentacoordination (ChemPhysChem 18/2023)	29
Cover Feature: Background‐Free Detection of Spin‐Exchange Dynamics at Ultra‐Low Magnetic Field (ChemPhysChem 19/2023)	29
Front Cover: Transitions of Collective Motions Driven by Phase Resetting (ChemPhysChem 12/2023)	29
Homogeneous Dephasing in Photosynthetic Bacterial Reaction Centers: Time Correlation Function Approach	27
	26
	25
Nanobubbles in Ultrapure Water Can Self‐Propel	24
A nuclear configuration interaction approach to study nuclear spin effects: an application to ortho‐ and para‐3He2@C60	23
Dissociation of N2 on a Si(111)‐7x7 Surface at Room Temperature	23

Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods	23
Front Cover: Binding Energy Partition of Promising IRAK‐4 Inhibitor (Zimlovisertib) for the Treatment of COVID‐19 Pneumonia (ChemPhysChem 24/2022)	22
Cover Feature: Low‐boiling Point Perfluorocarbon Nanodroplets as Dual‐Phase Dual‐Modality MR/US Contrast Agent (ChemPhysChem 24/2022)	22
Revisiting the TCNQF40/1−/2− Catalysis Mechanism for the [Fe(CN)6]3−/4−‐S2O32−/S4O62− Redo	22
Combined Modelling of Triply Paired Electronic States of HO2+ ion with 3 Symmetry using Coupled Eigen Model	22
Cover Feature: Optical Physical Mechanisms of Helicene Carbon Nanohoop with Möbius Topology (ChemPhysChem 8/2023)	22
N, S Co‐Doped Carbon Nanotubes Loaded With Cu Nanoclusters For Efficient Oxygen Reduction Reaction	21
Front Cover: Dissociation of N2 on a Si(111)‐7x7 Surface at Room Temperature (ChemPhysChem 15/2023)	21
Prediction of M3B4‐type MBenes as Promising Catalysts for CO2 Capture and Reduction	21
A Density Functional Benchmark for Dehydrogenation and Dehalogenation Reactions on Coinage Metal Surfaces	21
Assignment of a Physical Energy Scale for the Dimensionless Interaction Energies within the PRIME20 Peptide Model	21
Efficient and Accurate Description of Diels‐Alder Reactions Using Density Functional Theory**	21
Adducing Knowledge Capabilities of Instrumental Techniques Through the Exploration of Heterostructures’ Modification Methods	20
Nitrogen and Sulfur Doped Porous Carbon Sheet with Trace Amount of Iron as Efficient Polysulfide Conversion Catalyst for High Loading Lithium‐Sulfur Batteries	20
Molecular Oxygen Trimer: Multiplet Structures and Stability	20
Relationship between Phase Behavior and Conductivity of Imidazolium‐Based Ionic Liquids with Dicyanamide Anion	19
Comparison of Structural, Water‐Retaining and Sorption Properties of Acrylamide‐Based Hydrogels Cross‐Linked by Physical and Chemical Methods	19
Charge‐transfer Adducts vs Iodine(I) Complexes: Dual Role of Halogen Bonding in Reactions of Diiodine with N‐donor Bases	19
Will Nontoxic High‐Performance Perovskite Photovoltaics Ever Be Possible?	19
Electronic and Nonlinear Optical Properties of B(III)‐Submonoazaporphyrin‐π‐Diimide Compounds: A Density Functional Theory Study	19
Studies of the Catalytic Activity of New Nickel(II) Compounds Containing Pyridine Carboxylic Acids Ligands in Oligomerization Processes of Selected Olefins and Cyclohexyl Isocyanide	19
Redox Properties and in Vivo Magnetic Resonance Imaging of Cyclodextrin‐Polynitroxides Contrast Agents	19
On the Solvation Properties of Menthol‐Thymol Mixtures. A Molecular Dynamics Investigation	19
Accurate Geometry and Non‐Covalent Interactions in 1‐Phenylethanol and its Monohydrate: A Rotational Study	18
Converting Second‐Order Saddle Points to Transition States: New Principles for the Design of 4π Photoswitches	18
Carbon Dioxide Reduction on Transition Metal Dichalcogenides with Ni and Cu Edge Doping: A Density‐Functional Theory Study	18
Branching‐Chain Propagation of Parahydrogen‐Derived Nuclear Spin Order on a Catalyst Surface	18
High‐Performance Mo‐CoS2 Nanoplates Derived from Metal‐Organic Frameworks for Asymmetric Supercapacitor Applications	18
Predicting a New Δ‐Proton Sponge‐Base of 4,12‐Dihydrogen‐4,8,12‐triazatriangulene through Proton Affinity, Aromatic Stabilization Energy, and Aromatic Magnetism	18
Nonadiabatic Photodynamics of Amantadine and 1‐Cyanoadamantane Cations	18
Preferential Solvation by Trifluoroethanol Drives α ‐Helical Folding in the Disordered S2 Region of the Escargot Protein	18
Data‐Efficient Active Learning for Thermodynamic Integration: Acidity Constants of BiVO4 in Water	17
	17
Revisiting Numerical Solutions of Weakly Bound Noble Gases’ Vibrational Energy Levels Modeled by the Improved Lennard‐Jones Potential	17
Elaborating the Fluorescence Regulation and Quenching Mechanism of Sulfur‐for‐Oxygen Replacement for Fluorophores	17
Scattering of NO Molecules from a Graphite Surface: Selectivity of the Rotational Excitation by Inelastic Collisions	17
Innovative Sustainable Cellulose Pulp From Lygeum spartum and Recycled Paper: Development and Characterization	16
The Hunter Falls Prey: Photoinduced Oxidation of C60 in Inclusion Complex with Perfluorocycloparaphenylene	16
Adaptive Pruning for Increased Robustness and Reduced Computational Overhead in Gaussian Process Accelerated Saddle Point Searches	16
Computational Study of Carbon Dioxide Capture by Tertiary Amines	16
Resolving the Puzzling Observations in Trapping Dynamics of Polystyrene and Silica Microparticles Under Femtosecond Pulsed and Continuous‐Wave Excitations	16
The Interaction of Ether‐Based Functionalized Ionic Liquids in Lithium–Sulfur Batteries: A First‐Principles Study	16
Neuromorphic Liquids, Colloids, and Gels: A Review	16
Adsorption of Carbamazepine in All‐Silica Zeolites Studied with Density Functional Theory Calculations**	16
Broad‐Spectrum Diffusion Coefficient Measurements via Surface Plasmon Resonance: From Thermodynamics to Protein Conformational Disorders	16
Applications of Inorganic Hybrid Rare‐Earth Materials in Biological Diagnostics, X‐Ray Imaging, and Lighting Display	16
Revisiting CN − Formation Mechanisms in Electron Collisions with Benzonitrile	16
Theoretical Study on the H‐Atom Abstraction Reactions of Three Linear Pentanol Isomers + HȮ 2 Radical	16
Improved Conductivity and in Situ Formed Heterojunction via Zinc Doping in CuBi2O4 for Photoelectrochemical Water Splitting	16
Probing Composition Effects on the Intrinsic Energetics of Proton Transfer in Binary (HCl) m (H	16

Vibrational Sum Frequency Generation Spectra of Water‐Vapor Interfaces Covered by Alcohols: Effects of Surface Coverage and Coupling between Oscillators	15
When Dihedral Angles Mask Denticity in Molecular Conductance	15
Photocatalytic Hydrogen Production Activity and Mechanism of New Nickel‐Based Sulfur Complexes in Aqueous Solution	15
Tricyclic 1,4‐Diphosphinines: Local vs. Global Aromaticity	15
Concentration Effect, Structural Properties, and Driving Force on Aβ28 Dimerization with and without Zn2+ Cooperation: Learning from Replica Exchange Sampling**	15
Electrochemical NH‐Sulfoximidation with α‐Keto Acids	15
Acidity of Isomorphic Substituted Zeolites with B, Al and Ga Revisited	15
Hydrogels May Not Always Absorb Water: Strategies to Achieve Antiswelling and Negative Swelling	15
Cover Feature: Adaptive Pruning for Increased Robustness and Reduced Computational Overhead in Gaussian Process Accelerated Saddle Point Searches (ChemPhysChem 4/2026)	15
Catalytic NO Reduction by NO Pre‐Adsorbed RhCeO2NO− Clusters	15
Deciphering the Role of Substitution in Transition‐Metal Phosphorous Trisulfide (100) Surface: A Highly Efficient and Durable Pt‐free ORR Electrocatalyst	15
Linear and Two‐Dimensional Infrared Spectroscopy of the Multifunctional Vibrational Probe, 3‐(4‐Azidophenyl) Propiolonitrile. Deperturbing a Fermi Triad by Isotopic Substitution	14
Light‐Induced Transformation of a Supramolecular Gel to a Stronger Covalent Polymeric Gel	14
Using Energetic Information Quantities from Density Functional Theory to Simultaneously Identify Both Covalent and Noncovalent Interactions	14
Directly Bound Deuterons Increase X‐Nuclei Hyperpolarization using Dynamic Nuclear Polarization	14
Using Lateral Substitution to Control Conformational Preference and Phase Behaviour of Benzanilide‐based Liquid Crystal Dimers	14
3D‐Printed Fe‐Ni Porous Framework Structures for Efficient and Recyclable Degradation of Azo Dyes in Wastewater	14
Angle‐Dependent Raman Spectra of Crystal Polymorphs of GaO: A Computational Study	14
Galvanostatic Fast Charging of Alkali‐Ion Battery Materials at the Single‐Particle Level: A Map‐Driven Diagnosis	14
Cover Feature: Explicit Modelling of Spectral Bandshapes by a Mixed Quantum‐Classical Approach: Solvent Order and Temperature Effects in the Optical Spectra of Distyrylbenzene (ChemPhysChem 16/2024)	13
Cover Feature: Rotation‐Inversion Isomerization of Tertiary Carbamates: Potential Energy Surface Analysis of Multi‐Paths Isomerization Using Boltzmann Statistics (ChemPhysChem 1/2023)	13
Quantum Dynamics of O(3P)+HBr→OH+Br Reaction: Integral Cross Sections and Rate Constants and their Initial State Dependence	13
Going from Pt to PGM‐free Catalysts: Effects of Ink Compositions on PEM Water Electrolysis	13
Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy	13
Cover Feature: OH Radical‐Induced Oxidation in Nucleosides and Nucleotides Unraveled by Tandem Mass Spectrometry and Infrared Multiple Photon Dissociation Spectroscopy (ChemPhysChem 23/2023)	13
Shrinking Devices: Shape‐Memory Polymer Fabrication of Micro‐and Nanostructured Electrodes	13
Molecular‐Level Insight into the Chlorofluorocarbons Adsorption by Defective Covalent Organic Polymers	13
Investigating Possible Dipole‐Bound States of Cyanopolyynes: the Case for the C5N− Anion Detected in Interstellar Space	13
Front Cover: Blueshift in Trifurcated Hydrogen Bonds: A Tradeoff between Tetrel Bonding and Steric Repulsion (ChemPhysChem 1/2024)	13
	13
6‐Endo‐dig versus 5‐exo‐dig: Exploring Radical Cyclization Preference with First‐, Second‐, and Third‐row Linkers using High‐level Quantum Chemical Methods	13
Cover Feature: Activity‐Based Models to Predict Kinetics of Levulinic Acid Esterification (ChemPhysChem 4/2023)	13
Cover Feature: Controlling Chirogenic Effects in Porphyrin Based Supramolecular Systems: Theoretical Analysis Versus Experimental Observations (ChemPhysChem 11/2024)	13
Vibrational Features of Oxyamines: A Comparative Study of N,N‐Diethylhydroxylamine and N,N‐Diethylacetyloxyamine	13
Structure and Dynamics of Imidazolium in an Ionic Liquid‐PEGDA Iongel via IR, 2D‐IR, and NMR Spectroscopy	12
Electron and Spin Delocalization in [Co6Se8(PEt3)6]0/+1 Superatoms	12
Volcano‐like Activity Trends in Au@Pd Catalysts: The Role of Pd Loading and Nanoparticle Size	12
New Prediction Model of Surface and Interfacial Energies Based on COSMO‐UCE**	12
Solvent Effects on the 1H‐NMR Chemical Shifts of Imidazolium‐Based Ionic Liquids	12
Electronic Excitation Transfer Dynamics in a 3‐Site System Using an Incoherent Born‐Markov Rate Model	12
Reaction Kinetics of the Benzylation of Adenine in DMSO: Regio‐Selectivity Guided by Entropy	12
Near‐infrared Piezochromic Materials at High Pressure	12
The Importance of Reaction Energy in Predicting Chemical Reaction Barriers with Machine Learning Models	12
Cover Feature: A Magnetocaloric Glass from an Ionic‐Liquid Gadolinium Complex (ChemPhysChem 12/2022)	12
Band Structure Engineering of Single Pt Atoms on Fe−TiO2 for Enhanced Photocatalytic Performance	12
The Solute Polarization and Structural Effects on the Nonlinear Optical Response of Based Chromone Molecules	12
Protonation Effects on the Benzoxazine Formation Pathways and Products Distribution	12
Corrigendum: Protonation Effects on the Benzoxazine Formation Pathways and Products Distribution	12
Single Atom Sites in Ga‐Ni Supported Catalytically Active Liquid Metal Solutions (SCALMS) for Selective Ethylene Oligomerization	12
Nanoparticulate Co‐doped CuO/Multiwalled Carbon Nanotubes Composite for Dopamine	12
Understanding the CO2 Activation and Hydrogenation Mechanism on MXene under Electrochemical Conditions	12
Front Cover: Length‐Dependent Collective Vibrational Dynamics in Alpha‐Helices (ChemPhysChem 12/2022)	12
Aromaticity and Antiaromaticity Reversals between the Electronic Ground State and the Two Lowest Triplet States of Thiophene	12
Simulation of Hydrogen Adsorption in Hierarchical Silicalite: Role of Electrostatics and Surface Chemistry	12
A Tug of War between the Self‐ and Cross‐associating Hydrogen Bonds in Neutral Ammonia‐Water Clusters: Energetic Insights by Molecular Tailoring Approach	12
Mechanisms of Complete Dissociation of CO2 on Iron Clusters	12
Tailored Porous Transport Layers for Optimal Oxygen Transport in Water Electrolyzers: Combined Stochastic Reconstruction and Lattice Boltzmann Method	11
Adsorption Structures, Vibrational Raman Spectra and Chemical Binding Properties of Thioglycolic Acid on Cu(111) Surfaces: A DFT Study	11
Cover Feature: In Silico Screening of CO2‐Dipeptide Interactions for Bioinspired Carbon Capture (ChemPhysChem 4/2025)	11
	11
Rationalizing Aggregate Structures with Orbital Contributions to the Exchange‐Repulsion Energy**	11
Photodetachment of Deprotonated R‐Mandelic Acid: The Role of Proton Delocalization on the Radical Stability	11
Theoretical Prediction of Enhanced Hydrogen Evolution Reaction Electrocatalysts Based on Tantalum Phosphide	11
Theoretical Rotational and Vibrational Spectral Data for the Hypermagnesium Oxide Species Mg2O and Mg2O+	11
Interfacial Electronic Structure Engineering of NiCo2Se4 and NiTe2 Nanorods for Enhanced Hydrogen Evolution Reaction	11
Computational Modeling: Up‐to‐Date Approaches and Cutting‐Edge Applications from Clusters, Nanostructures to Bulk Systems	11
The σ+π dual aromaticity of typical bi‐tetrazole ring molecule TKX‐50	11
Indirect Grafting of Alkyl Ammonium Ions onto Glassy Carbon and Coal Surface. Enhancing the Performance of Heterogeneous Asymmetric Membranes	11
Does Chiral Sensitivity of a Structure Depend on the Metal Core? Alkali Ion Complexes of Cyclo(Tyr‐Tyr)	11
Evaluation of Resorcinarene Trimer Methanesulfonate Aggregation in the Presence of Inorganic Salts and Biomolecules in Aqueous Solutions Using UV–vis Spectroscopy and Electrophoresis	11
Interpretable Machine Learning Models for Practical Antimonate Electrocatalyst Performance	11
Evidence for Anion‐Anion Interaction in Amino Acid Ionic Liquids Probed by Far‐Infrared Spectroscopy	11
Organic Supercapacitors as the Next Generation Energy Storage Device: Emergence, Opportunity, and Challenges	11
Cover Feature: Disentangling the Conformational Space and Structural Preferences of Tetrahydrofurfuryl Alcohol Using Rotational Spectroscopy and Computational Chemistry (ChemPhysChem 12/2024)	11
Role of Triplet States in the Photolysis of Proteogenic Amino Acids	11
	11
Luminescence Mechanisms of Quaternary Zn−Ag−In−S Nanocrystals: ZnS:Ag, In or AgInS2:Zn?	11
Interfacial Coupling of Graphene with Nickel Nanoparticles for Water Splitting and Urea Oxidation: A Spectroelectrochemical Investigation	11
Front Cover: Application of Exciton Coupling for Characterization of Nanographene Edge (ChemPhysChem 5/2024)	11
Identifying Exchangeable Protons in a 1D NMR Spectrum by Spatially Selective Exchange‐Editing	11

Properties of Bisdiazo Compounds and Their Derived Carbenes via Density Functional Theory	11
Low‐Cost Periodic Calculations of Metal‐Organic Frameworks: A GFN1‐xTB Perspective	10
Controlling the Nature of Photoluminescence of Emissive Metal Nanoclusters	10
Rotation‐Inversion Isomerization of Tertiary Carbamates: Potential Energy Surface Analysis of Multi‐Paths Isomerization Using Boltzmann Statistics	10
Unraveling the Mechanism of Oxygen Electrocatalysis on Transition Metal‐Free Single‐Atom‐Doped Holey Graphyne	10
CORRIGENDUM: Molecular Oxygen Trimer: Multiplet Structures and Stability	10
Low‐Energy Elastic Scattering of Electrons from 2H‐Pyran and 4H‐Pyran with Time Delay Analysis of Resonances	10
The Hydrogen Evolution Activity of BaZrS 3 , BaTiS 3 , and BaVS 3	10
Alkali‐Metal‐Supported Be—X (X = C, N, and B) Quadruple Orbital Overlapping Interactions	10
The Rivalry between Intramolecular Tetrel Bonds and Intermolecular Hydrogen Bonds in (O−Si) Chelates of N‐Silylmethylamides and ‐ureas. A Theoretical Study	10
Interplay of Solvation Dynamics and Ion Transport in Concentrated LiFSA–Sulfone Electrolytes	10
Cr2O3 Promoted In2O3 Catalysts for CO2 Hydrogenation to Methanol	10
Quantitative Descriptions of Dewar‐Chatt‐Duncanson Bonding Model: A Case Study of Zeise and Its Family Ions	10
	10
Equiatomic binary phases of Copper‐Rare Earth Elements. An overview of monocuprides from first‐principles calculations	10
An Automatic Pathway Searching Strategy in Enzyme Catalysis: A Case Study of Lm CpfC	10
Toward Rational Design of Mononuclear Nickel Complexes as Water Oxidation Catalysts Exploring the Ligand Effects on the Rate‐Determining Step	10
Structural, Magnetic, and Optical Properties of Sol–Gel Synthesized Fe‐Doped NiO Nanoparticles with Tunable Fluorescence Toward Acridine Orange	10
Theoretical Study on B‐doped FeN4 Catalyst for Potential‐Dependent Oxygen Reduction Reaction	10
On the Catalytic Performance of (ZrO)n (n=1–4) Clusters for CO Oxidation: A DFT Study	10
Plasmon Mediated Electron Transfer and Temperature Dependent Electron‐Phonon Scattering in Gold Nanoparticles Embedded in Dielectric Films	10
Metallofullertube: From Tubular Endohedral Structures to Properties	10
Highly Efficient and Chemoselective Tandem Hydroformylation‐Hydrogenation of Alkenes to Alcohols over g‐CN Supported Bimetallic Rh and Co Nanoparticles Catalysts	10
Bayesian Optimization for Efficient Prediction of Gas Uptake in Nanoporous Materials	10
Cation‐lone Pair Interaction in Alkali/Alkaline Earth Metal Ion‐Heavier Borazine Analogue Complexes	10
Reaction Cycle of Operating Pump Protein Studied with Single‐Molecule Spectroscopy**	10
Relativistic Density Functional NMR Tensors Analyzed with Spin‐free Localized Molecular Orbitals	10
On the Nature of the Out‐of‐Plane Distortions in Subporphyrins	10
Photoelectron Photoion Coincidence Spectroscopy of Biradicals	10
Charge Density and Magnetic Properties in Cobalt(II) Single‐Molecule Magnets: Impact of Ligand Substitution	10
Thermal Properties of MXenes and Relevant Applications	10
Extractive Mass Transfer of Zr(IV) into a Hydrophobic Ionic Liquid Medium Containing Diglycolamide Extractant: Solvent Extraction and Spectroscopic Analysis	10
Noble Metal‐Free Inorganic Photocatalyst Consisting of Antimony‐Doped Tin Oxide Nanorod and Titanium oxide for Two‐Electron Oxygen Reduction Reaction	9
Strategies and Challenges of Utilizing Cation Effects in Membrane Electrode Assemblies for CO2 Reduction	9
Cover Feature: Catalytic Deactivation and Regeneration of Nickel Microparticles in a Home‐Built Microchannel‐Coupled Millireactor: Substrate Specificity and Multiphase Flow Dependency (ChemPhysChem 14	9
Recent Progress on CoP as Anodes for Metal–Ion Batteries	9
Photophysics of Benzoxazole and Dicyano Functionalised Diketopyrrolopyrrole Derivatives: Insights into Ultrafast Processes and the Triplet State	9
	9
The Influence of Deuterium Isotope Effects on Structural Rearrangements, Ensemble Equilibria, and Hydrogen Bonding in Protic Ionic Liquids	9
Regulating Efficient and Selective Single‐atom Catalysts for Electrocatalytic CO2 Reduction	9
Electron interaction with DNA constituents in aqueous phase	9
Confinement Dynamics of Nanodroplets between Two Surfaces: Effects of Wettability and Electric Field	9
Ab Initio Study of H‐Bond Dynamics in Three‐Component Crystals Comprising (DABCOH+)n Polycationic Chains	9
Microkinetic Modelling of Electrochemical Oxygen Evolution Reaction on Ir(111)@N‐Graphene Surface	9
Phase Diagrams of Anthracene Derivatives in Pyridinium Ionic Liquids	9
Theoretical Simulations of Kinetic Isotope Effects on Decarboxylation of 3‐Carboxybenzisoxazole	9
Investigating the Role of UiO‐68 Supported N‐Heterocyclic Carbene‐Based Metal‐Hydrides for CO Hydrogenation to Methanol	9
Coarsening of Quasi Two‐Dimensional Emulsions Formed by Islands in Free‐Standing Smectic Films	9
Progress and Perspectives of Lithium Isotope Separation	9
Binding Energy Partition of Promising IRAK‐4 Inhibitor (Zimlovisertib) for the Treatment of COVID‐19 Pneumonia	9
Predicting 195Pt NMR Chemical Shifts in Water‐Soluble Inorganic/Organometallic Complexes with a Fast and Simple Protocol Combining Semiempirical Modeling and Machine Learning	9
Optimizing Extended Tight‐Binding Methods for Metal‐Surface Interactions	9
Turning Trash to Treasure: The Influence of Carbon Waste Source on the Photothermal Behaviour of Plasmonic Titanium Carbide Interfaces	9
Azo‐Cyanamide Bridged Dinuclear Iron Complexes Exhibiting no Electronic Coupling but Moderate Magnetic Coupling between the two Iron Centers	9
Prediction of the Phase Composition Profile of Three‐Compound Mixtures in Liquid‐Liquid Equilibrium: A Chemoinformatics Approach	9
Statistically Derived Proxy Potentials Accelerate Geometry Optimization of Crystal Structures	9
Adsorption of Isolated and Hydrated Linear Per‐ and Polyfluoroalkyl Substances on Clay Surfaces: A Periodic Density Functional Theory Study	9
Front Cover: Development of a Core–Shell Heterojunction TiO2/SrTiO3 Electrolyte with Improved Ionic Conductivity (ChemPhysChem 11/2022)	9
Sustained Synthesis of Ultra‐Long Gold Wires via an Open Microfluidic System	9
Post‐CCSD(T) Thermochemistry of Chlorine Fluorides as a Challenging Test Case for Evaluating Density Functional Theory and Composite Ab Initio Methods	9
A Case Study on the Use of Binding Free Energies to Screen Inhibitors of Human Carbonic Anhydrase II	9
Simultaneous Ring‐Opening and Dehydrogenation of Diarylethene Induced by Tunneling Electrons	9
Trianglimine‐Mediated Selective Sieving of Cis Isomer from the Mixture of Dihaloethenes: A Combined Molecular Dynamics and DFT Investigation	9
Cover Feature: Vibrationally Resolved Inner‐Shell Photoexcitation of the Molecular Anion C2− (ChemPhysChem 11/2023)	9
	9
Fe‐Doped CoS2 Nanoarrays: Efficient Electrocatalytic Nitrate Reduction to Ammonia under Ambient Conditions	9
On the Vapor Pressures, Phase Transitions, and Solid‐State Fluorescence of 2‐(2‐Hydroxyphenyl)benzoxazole and 2‐(2‐Hydroxyphenyl)benzothiazole	9
Front Cover: Use of 5,10‐Disubstituted Dibenzoazaborines and Dibenzophosphaborines as Cyclic Supports of Frustrated Lewis Pairs for the Capture of CO2 (ChemPhysChem 18/2022)	9
The Effect of Pulling and Twisting Forces on Chameleon Sequence Peptides**	9
NMR Self‐Diffusion and Transverse Relaxation Time in Bitumen: The Effect of Aging	9
Mononuclear Molybdenum and Tungsten Phosphine Complexes for Catalytic Ammonia Synthesis: Development of the pentaPod Concept	9
Computational Energy Spectra of the H2O@C70 Endofullerene	9
Approaching the Lower Temporal Limit of Laser‐Produced Plasma Sources for Table‐Top Soft X‐Ray NEXAFS Measurements	9
Cover Feature: Dynamics of Citrate Coordination on Gold Nanoparticles Under Low Specific Power Laser‐Induced Heating (ChemPhysChem 7/2023)	9
Lutidyl Radical Photoelectron Spectra Reveal Additive Substituent Effects on Benzyl Derivatives’ Ionization Energy	9
Porous Mn2+ Magnet with a Pt−Cl Framework: Correlation between Water Vapor Adsorption/Desorption and Slow Magnetic Relaxation	9
Oxygen‐Induced Dissociation of a Single Water Molecule in Confined 2‐D Layers: A Semiempirical Study	9
What Makes a Designer Solvent Efficient for Capturing Volatile Organic Compounds?—A Molecular Perspective	9
Synthesis of Multi‐Functional Graphene Monolayers via Bipolar Electrochemistry	8
Vibrational Properties of LaNb0.8M0.2O4‐δ (M=As, Sb, V, and Ta)	8
Embarking on a New Journey	8
Activity‐Based Models to Predict Kinetics of Levulinic Acid Esterification	8
Improving the Catalytic Performance of the Hydrogen Evolution Reaction of α‐MoB2 via Rational Doping by Transition Metal Elements	8
Cover Feature: Comparison of the Ability of N‐Bases to Engage in Noncovalent Bonds (ChemPhysChem 15/2023)	8
Cover Feature: Phosphide‐Based Electrocatalysts for Urea Electrolysis: Recent Trends and Progress (ChemPhysChem 8/2024)	8
Cover Feature: Self‐Consistent Convolutional Density Functional Approximations: Application to Adsorption at Metal Surfaces (ChemPhysChem 10/2024)	8
Front Cover: Adsorption of CO on α‐Al2O3(0001): A Combined Experimental and Computational Study (ChemPhysChem 10/2025)	8
Editorial – “Special Collection: 30 Years of PIP” – Physicochemistry of Interfacial Phenomena	8
Cover Feature: Production of Dihydrogen Using Ammonia Borane as Reagent and Pyrazole as Catalyst (ChemPhysChem 17/2023)	8
In Silico Screening of CO2‐Dipeptide Interactions for Bioinspired Carbon Capture	8
Cover Feature: Comprehensive Theoretical View of the [Cu2O2] Side‐on‐Peroxo‐/Bis‐μ‐Oxo Equilibria (ChemPhysChem 14/2022)	8
Towards π‐wires on a semiconductor surface: Benzyne on Si(001)	8
Front Cover: Synthesis of Multi‐Functional Graphene Monolayers via Bipolar Electrochemistry (ChemPhysChem 16/2024)	8
The Inner Hydration in Surfactant/Cholesterol Vesicles Differs from the Outer One: A Spectroscopic Investigation	8
	8