ChemPhysChem

Article	Citations
The Steady‐State ALTADENA RASER Generates Continuous NMR Signals	95
	72
Mechanistic Insights into the Selectivity of Norcarane Oxidation by Oxo‐Manganese(V) Porphyrin Complexes	68
Electronic and Nonlinear Optical Properties of B(III)‐Submonoazaporphyrin‐π‐Diimide Compounds: A Density Functional Theory Study	46
An Algebraic Blueprint for Predicting Turnover Numbers and Endpoints in Photocatalysis	37
Cover Feature: Increasing Complexity in Adamantyl Thioethers Characterized by Rotational Spectroscopy (ChemPhysChem 23/2023)	36
Computational Study of Carbon Dioxide Capture by Tertiary Amines	35
Elucidating the Mechanism of Simultaneous Activation of CH4 and CO2 Mediated by Single Group 10 Metal Anions in Gas Phase	34
Molecular Oxygen Trimer: Multiplet Structures and Stability	32
Cover Feature: Energetics of Sulfur‐Carbon Interaction (ChemPhysChem 24/2022)	32
Coadsorption of ZnTPP and 2HMCTPP on Rutile TiO2(110)	29
Front Cover: An Algebraic Blueprint for Predicting Turnover Numbers and Endpoints in Photocatalysis (ChemPhysChem 3/2024)	28
Cover Feature: Overcoming Challenges in Density Functional Theory‐Based Calculations of Hyperfine Coupling Constants for Heavy Heteroatom Radicals (ChemPhysChem 10/2025)	27
Substituent Effect of Superhalogens on the Metallodrug IMeAuCl: A DFT Study	27
Thermal Isomerization Rates of New Azoquinoline‐Functionalized Copolymers as a Function of Substitution Patterns	27
The Interaction of Ether‐Based Functionalized Ionic Liquids in Lithium–Sulfur Batteries: A First‐Principles Study	26
Front Cover: Transitions of Collective Motions Driven by Phase Resetting (ChemPhysChem 12/2023)	25
Adducing Knowledge Capabilities of Instrumental Techniques Through the Exploration of Heterostructures’ Modification Methods	25
The Hunter Falls Prey: Photoinduced Oxidation of C60 in Inclusion Complex with Perfluorocycloparaphenylene	25
Cover Feature: Background‐Free Detection of Spin‐Exchange Dynamics at Ultra‐Low Magnetic Field (ChemPhysChem 19/2023)	25
Cover Feature: Rare Spin Avoided σ‐σ Diradical Planar Tetracoordinate Boron Cluster: A Proto‐Star for Planar Pentacoordination (ChemPhysChem 18/2023)	25
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Homogeneous Dephasing in Photosynthetic Bacterial Reaction Centers: Time Correlation Function Approach	23
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Charge‐transfer Adducts vs Iodine(I) Complexes: Dual Role of Halogen Bonding in Reactions of Diiodine with N‐donor Bases	23

Revisiting Numerical Solutions of Weakly Bound Noble Gases’ Vibrational Energy Levels Modeled by the Improved Lennard‐Jones Potential	22
Nanobubbles in Ultrapure Water Can Self‐Propel	21
Branching‐Chain Propagation of Parahydrogen‐Derived Nuclear Spin Order on a Catalyst Surface	21
A nuclear configuration interaction approach to study nuclear spin effects: an application to ortho‐ and para‐3He2@C60	21
Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods	21
Applications of Inorganic Hybrid Rare‐Earth Materials in Biological Diagnostics, X‐Ray Imaging, and Lighting Display	20
N, S Co‐Doped Carbon Nanotubes Loaded With Cu Nanoclusters For Efficient Oxygen Reduction Reaction	20
Studies of the Catalytic Activity of New Nickel(II) Compounds Containing Pyridine Carboxylic Acids Ligands in Oligomerization Processes of Selected Olefins and Cyclohexyl Isocyanide	20
Prediction of M3B4‐type MBenes as Promising Catalysts for CO2 Capture and Reduction	19
Dissociation of N2 on a Si(111)‐7x7 Surface at Room Temperature	19
Cover Feature: Optical Physical Mechanisms of Helicene Carbon Nanohoop with Möbius Topology (ChemPhysChem 8/2023)	18
On the Solvation Properties of Menthol‐Thymol Mixtures. A Molecular Dynamics Investigation	18
Cover Feature: Low‐boiling Point Perfluorocarbon Nanodroplets as Dual‐Phase Dual‐Modality MR/US Contrast Agent (ChemPhysChem 24/2022)	18
Front Cover: Binding Energy Partition of Promising IRAK‐4 Inhibitor (Zimlovisertib) for the Treatment of COVID‐19 Pneumonia (ChemPhysChem 24/2022)	18
Revisiting the TCNQF40/1−/2− Catalysis Mechanism for the [Fe(CN)6]3−/4−‐S2O32−/S4O62− Redo	18
Excited State Assignment and State‐Resolved Photoelectron Circular Dichroism in Chalcogen‐Substituted Fenchones	17
Combined Modelling of Triply Paired Electronic States of HO2+ ion with 3 Symmetry using Coupled Eigen Model	17
The Bond Energy of the Carbon Skeleton in Polyaromatic Halohydrocarbon Molecules	17
Scattering of NO Molecules from a Graphite Surface: Selectivity of the Rotational Excitation by Inelastic Collisions	17
Predicting a New Δ‐Proton Sponge‐Base of 4,12‐Dihydrogen‐4,8,12‐triazatriangulene through Proton Affinity, Aromatic Stabilization Energy, and Aromatic Magnetism	17
Front Cover: Dissociation of N2 on a Si(111)‐7x7 Surface at Room Temperature (ChemPhysChem 15/2023)	17
Converting Second‐Order Saddle Points to Transition States: New Principles for the Design of 4π Photoswitches	16
Nonadiabatic Photodynamics of Amantadine and 1‐Cyanoadamantane Cations	16
Nitrogen and Sulfur Doped Porous Carbon Sheet with Trace Amount of Iron as Efficient Polysulfide Conversion Catalyst for High Loading Lithium‐Sulfur Batteries	16
A Density Functional Benchmark for Dehydrogenation and Dehalogenation Reactions on Coinage Metal Surfaces	16
Assignment of a Physical Energy Scale for the Dimensionless Interaction Energies within the PRIME20 Peptide Model	16
Revisiting CN− Formation Mechanisms in Electron Collisions with Benzonitrile	16
Exploring the Reaction Mechanism of Methanol Steam Reforming on CuZn 3 O 3 Cluster: A Density Func	16
High‐Performance Mo‐CoS2 Nanoplates Derived from Metal‐Organic Frameworks for Asymmetric Supercapacitor Applications	15
Accurate Geometry and Non‐Covalent Interactions in 1‐Phenylethanol and its Monohydrate: A Rotational Study	15
Energetic Ordering of Hydrogen Bond Strengths in Methanol‐Water Clusters: Insights via Molecular Tailoring Approach	15
The Effect of Fluorinated Solvents on the Physicochemical Properties, Ionic Association, and Free Volume of a Prototypical Solvate Ionic Liquid	15
Neuromorphic Liquids, Colloids, and Gels: A Review	15
Bioinspired Hybrid Polymeric Microspheres with Fractionated Lignin: Advanced Sorbents for Tetracycline Removal from Aqueous Media	15
Cover Feature: Deciphering Mg‐Surface Interactions with Unsaturated Hydrocarbons: An Integrated Experimental‐Theoretical Study (ChemPhysChem 7/2025)	15
Carbon Dioxide Reduction on Transition Metal Dichalcogenides with Ni and Cu Edge Doping: A Density‐Functional Theory Study	15
Comparison of Structural, Water‐Retaining and Sorption Properties of Acrylamide‐Based Hydrogels Cross‐Linked by Physical and Chemical Methods	15
Adsorption of Carbamazepine in All‐Silica Zeolites Studied with Density Functional Theory Calculations**	15
Data‐Efficient Active Learning for Thermodynamic Integration: Acidity Constants of BiVO4 in Water	15
Efficient and Accurate Description of Diels‐Alder Reactions Using Density Functional Theory**	14
Corrigendum: Protonation Effects on the Benzoxazine Formation Pathways and Products Distribution	14
Solvent Effects on the 1H‐NMR Chemical Shifts of Imidazolium‐Based Ionic Liquids	14
Redox Properties and in Vivo Magnetic Resonance Imaging of Cyclodextrin‐Polynitroxides Contrast Agents	14
Improved Conductivity and in Situ Formed Heterojunction via Zinc Doping in CuBi2O4 for Photoelectrochemical Water Splitting	14
Interfacial Coupling of Graphene with Nickel Nanoparticles for Water Splitting and Urea Oxidation: A Spectroelectrochemical Investigation	14
3D‐Printed Fe‐Ni Porous Framework Structures for Efficient and Recyclable Degradation of Azo Dyes in Wastewater	14
Elaborating the Fluorescence Regulation and Quenching Mechanism of Sulfur‐for‐Oxygen Replacement for Fluorophores	14
Near‐infrared Piezochromic Materials at High Pressure	14
Hydrogels May Not Always Absorb Water: Strategies to Achieve Antiswelling and Negative Swelling	14
Band Structure Engineering of Single Pt Atoms on Fe−TiO2 for Enhanced Photocatalytic Performance	13

Cover Feature: SiC Monolayers as Promising Substrates for the Development of Highly Stable Palladium Single Atom Catalysts: A Density Functional Theory Study (ChemPhysChem 9/2022)	13
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Cover Feature: A Magnetocaloric Glass from an Ionic‐Liquid Gadolinium Complex (ChemPhysChem 12/2022)	13
Electronic Excitation Transfer Dynamics in a 3‐Site System Using an Incoherent Born‐Markov Rate Model	13
Deciphering the Role of Substitution in Transition‐Metal Phosphorous Trisulfide (100) Surface: A Highly Efficient and Durable Pt‐free ORR Electrocatalyst	13
Volcano‐like Activity Trends in Au@Pd Catalysts: The Role of Pd Loading and Nanoparticle Size	13
Front Cover: Length‐Dependent Collective Vibrational Dynamics in Alpha‐Helices (ChemPhysChem 12/2022)	13
Reaction Kinetics of the Benzylation of Adenine in DMSO: Regio‐Selectivity Guided by Entropy	13
Photocatalytic Hydrogen Production Activity and Mechanism of New Nickel‐Based Sulfur Complexes in Aqueous Solution	13
Does Chiral Sensitivity of a Structure Depend on the Metal Core? Alkali Ion Complexes of Cyclo(Tyr‐Tyr)	13
Understanding the CO2 Activation and Hydrogenation Mechanism on MXene under Electrochemical Conditions	13
The Importance of Reaction Energy in Predicting Chemical Reaction Barriers with Machine Learning Models	13
Concentration Effect, Structural Properties, and Driving Force on Aβ28 Dimerization with and without Zn2+ Cooperation: Learning from Replica Exchange Sampling**	12
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Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy	12
Mechanisms of Complete Dissociation of CO2 on Iron Clusters	12
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)	12
Protonation Effects on the Benzoxazine Formation Pathways and Products Distribution	12
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Molecular‐Level Insight into the Chlorofluorocarbons Adsorption by Defective Covalent Organic Polymers	12
Electron and Spin Delocalization in [Co6Se8(PEt3)6]0/+1 Superatoms	12
Cover Feature: OH Radical‐Induced Oxidation in Nucleosides and Nucleotides Unraveled by Tandem Mass Spectrometry and Infrared Multiple Photon Dissociation Spectroscopy (ChemPhysChem 23/2023)	12
Using Lateral Substitution to Control Conformational Preference and Phase Behaviour of Benzanilide‐based Liquid Crystal Dimers	12
Quantum Dynamics of O(3P)+HBr→OH+Br Reaction: Integral Cross Sections and Rate Constants and their Initial State Dependence	12
6‐Endo‐dig versus 5‐exo‐dig: Exploring Radical Cyclization Preference with First‐, Second‐, and Third‐row Linkers using High‐level Quantum Chemical Methods	12
Shrinking Devices: Shape‐Memory Polymer Fabrication of Micro‐and Nanostructured Electrodes	12
Cover Feature: Activity‐Based Models to Predict Kinetics of Levulinic Acid Esterification (ChemPhysChem 4/2023)	12
Cover Feature: Controlling Chirogenic Effects in Porphyrin Based Supramolecular Systems: Theoretical Analysis Versus Experimental Observations (ChemPhysChem 11/2024)	12
Tricyclic 1,4‐Diphosphinines: Local vs. Global Aromaticity	12
Cover Feature: Rotation‐Inversion Isomerization of Tertiary Carbamates: Potential Energy Surface Analysis of Multi‐Paths Isomerization Using Boltzmann Statistics (ChemPhysChem 1/2023)	12
Angle‐Dependent Raman Spectra of Crystal Polymorphs of GaO: A Computational Study	12
Vibrational Features of Oxyamines: A Comparative Study of N,N‐Diethylhydroxylamine and N,N‐Diethylacetyloxyamine	11
Linear and Two‐Dimensional Infrared Spectroscopy of the Multifunctional Vibrational Probe, 3‐(4‐Azidophenyl) Propiolonitrile. Deperturbing a Fermi Triad by Isotopic Substitution	11
Catalytic NO Reduction by NO Pre‐Adsorbed RhCeO2NO− Clusters	11
Directly Bound Deuterons Increase X‐Nuclei Hyperpolarization using Dynamic Nuclear Polarization	11
Going from Pt to PGM‐free Catalysts: Effects of Ink Compositions on PEM Water Electrolysis	11
Vibrational Sum Frequency Generation Spectra of Water‐Vapor Interfaces Covered by Alcohols: Effects of Surface Coverage and Coupling between Oscillators	11
Front Cover: Blueshift in Trifurcated Hydrogen Bonds: A Tradeoff between Tetrel Bonding and Steric Repulsion (ChemPhysChem 1/2024)	11
Luminescence Mechanisms of Quaternary Zn−Ag−In−S Nanocrystals: ZnS:Ag, In or AgInS2:Zn?	11
Broad‐Spectrum Diffusion Coefficient Measurements via Surface Plasmon Resonance: From Thermodynamics to Protein Conformational Disorders	11
Galvanostatic Fast Charging of Alkali‐Ion Battery Materials at the Single‐Particle Level: A Map‐Driven Diagnosis	11
Aromaticity and Antiaromaticity Reversals between the Electronic Ground State and the Two Lowest Triplet States of Thiophene	11
Acidity of Isomorphic Substituted Zeolites with B, Al and Ga Revisited	11
Rationalizing Aggregate Structures with Orbital Contributions to the Exchange‐Repulsion Energy**	11
Investigating Possible Dipole‐Bound States of Cyanopolyynes: the Case for the C5N− Anion Detected in Interstellar Space	11
Progress and Perspectives of Lithium Isotope Separation	10
Cover Feature: Temperature and Composition Dependent Optical Properties of CdSe/CdS Dot/Rod‐Based Aerogel Networks (ChemPhysChem 2/2022)	10
Electrochemical NH‐Sulfoximidation with α‐Keto Acids	10
New Prediction Model of Surface and Interfacial Energies Based on COSMO‐UCE**	10
The Solute Polarization and Structural Effects on the Nonlinear Optical Response of Based Chromone Molecules	10
The σ+π dual aromaticity of typical bi‐tetrazole ring molecule TKX‐50	10
Cover Feature: In Silico Screening of CO2‐Dipeptide Interactions for Bioinspired Carbon Capture (ChemPhysChem 4/2025)	10
Interfacial Electronic Structure Engineering of NiCo2Se4 and NiTe2 Nanorods for Enhanced Hydrogen Evolution Reaction	10
CORRIGENDUM: Molecular Oxygen Trimer: Multiplet Structures and Stability	10
Photodetachment of Deprotonated R‐Mandelic Acid: The Role of Proton Delocalization on the Radical Stability	10
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Toward Rational Design of Mononuclear Nickel Complexes as Water Oxidation Catalysts Exploring the Ligand Effects on the Rate‐Determining Step	10
Using Energetic Information Quantities from Density Functional Theory to Simultaneously Identify Both Covalent and Noncovalent Interactions	10
Single Atom Sites in Ga‐Ni Supported Catalytically Active Liquid Metal Solutions (SCALMS) for Selective Ethylene Oligomerization	10
Light‐Induced Transformation of a Supramolecular Gel to a Stronger Covalent Polymeric Gel	10
Photoelectron Photoion Coincidence Spectroscopy of Biradicals	10
Reaction Cycle of Operating Pump Protein Studied with Single‐Molecule Spectroscopy**	10
Dissociative Adsorption of H2S on Li(110) Surface Using Density Functional Theory Calculations and Car‐Parrinello Molecular Dynamics Simulations	10
Quantitative Descriptions of Dewar‐Chatt‐Duncanson Bonding Model: A Case Study of Zeise and Its Family Ions	10
Role of Triplet States in the Photolysis of Proteogenic Amino Acids	10
Highly Efficient and Chemoselective Tandem Hydroformylation‐Hydrogenation of Alkenes to Alcohols over g‐CN Supported Bimetallic Rh and Co Nanoparticles Catalysts	10
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A Tug of War between the Self‐ and Cross‐associating Hydrogen Bonds in Neutral Ammonia‐Water Clusters: Energetic Insights by Molecular Tailoring Approach	10
When Dihedral Angles Mask Denticity in Molecular Conductance	10
Simulation of Hydrogen Adsorption in Hierarchical Silicalite: Role of Electrostatics and Surface Chemistry	10
Cr2O3 Promoted In2O3 Catalysts for CO2 Hydrogenation to Methanol	10
Front Cover: Application of Exciton Coupling for Characterization of Nanographene Edge (ChemPhysChem 5/2024)	10
Low‐Cost Periodic Calculations of Metal‐Organic Frameworks: A GFN1‐xTB Perspective	10
Retaining Hückel Aromaticity in the Triplet Excited State of Azobenzene	10
Organic Supercapacitors as the Next Generation Energy Storage Device: Emergence, Opportunity, and Challenges	9
Exploring the Effects of Ionic Defects on the Stability of CsPbI3 with a Deep Learning Potential	9
Interpretable Machine Learning Models for Practical Antimonate Electrocatalyst Performance	9
Influence of Pt Alloying on the Fluorescence of Fully Inorganic, Colloidal Gold Nanoclusters	9
Adsorption Structures, Vibrational Raman Spectra and Chemical Binding Properties of Thioglycolic Acid on Cu(111) Surfaces: A DFT Study	9
Metallofullertube: From Tubular Endohedral Structures to Properties	9

Theoretical Study on B‐doped FeN4 Catalyst for Potential‐Dependent Oxygen Reduction Reaction	9
Theoretical Simulations of Kinetic Isotope Effects on Decarboxylation of 3‐Carboxybenzisoxazole	9
The Rivalry between Intramolecular Tetrel Bonds and Intermolecular Hydrogen Bonds in (O−Si) Chelates of N‐Silylmethylamides and ‐ureas. A Theoretical Study	9
Coarsening of Quasi Two‐Dimensional Emulsions Formed by Islands in Free‐Standing Smectic Films	9
Evidence for Anion‐Anion Interaction in Amino Acid Ionic Liquids Probed by Far‐Infrared Spectroscopy	9
Cation‐lone Pair Interaction in Alkali/Alkaline Earth Metal Ion‐Heavier Borazine Analogue Complexes	9
Low‐Energy Elastic Scattering of Electrons from 2H‐Pyran and 4H‐Pyran with Time Delay Analysis of Resonances	9
Simultaneous Ring‐Opening and Dehydrogenation of Diarylethene Induced by Tunneling Electrons	9
The Hydrogen Evolution Activity of BaZrS3, BaTiS3, and BaVS3 Chalcogenide Perovskites	9
Unraveling the Mechanism of Oxygen Electrocatalysis on Transition Metal‐Free Single‐Atom‐Doped Holey Graphyne	9
Identifying Exchangeable Protons in a 1D NMR Spectrum by Spatially Selective Exchange‐Editing	9
Rotation‐Inversion Isomerization of Tertiary Carbamates: Potential Energy Surface Analysis of Multi‐Paths Isomerization Using Boltzmann Statistics	9
Extractive Mass Transfer of Zr(IV) into a Hydrophobic Ionic Liquid Medium Containing Diglycolamide Extractant: Solvent Extraction and Spectroscopic Analysis	9
Equiatomic binary phases of Copper‐Rare Earth Elements. An overview of monocuprides from first‐principles calculations	9
Tailored Porous Transport Layers for Optimal Oxygen Transport in Water Electrolyzers: Combined Stochastic Reconstruction and Lattice Boltzmann Method	9
Structural, Magnetic, and Optical Properties of Sol–Gel Synthesized Fe‐Doped NiO Nanoparticles with Tunable Fluorescence Toward Acridine Orange	9
Synthesis and Mechanical Properties of sub 5‐μm PolyUiO‐66 Thin Films on Gold Surfaces	9
Harmonic Scale Factors of Fundamental Transitions for Dispersion‐corrected Quantum Chemical Methods	9
PHRONESIS: A One‐Shot Approach for Sequential Assignment of Protein Resonances by Ultrafast MAS Solid‐State NMR Spectroscopy	9
Time‐Dependent Hydrogen Bond Network Formation in Glycerol‐Based Deep Eutectic Solvents	9
Bayesian Optimization for Efficient Prediction of Gas Uptake in Nanoporous Materials	9
Controlling the Nature of Photoluminescence of Emissive Metal Nanoclusters	9
Plasmon Mediated Electron Transfer and Temperature Dependent Electron‐Phonon Scattering in Gold Nanoparticles Embedded in Dielectric Films	9
An Automatic Pathway Searching Strategy in Enzyme Catalysis: A Case Study of LmCpfC	9
Theoretical Prediction of Enhanced Hydrogen Evolution Reaction Electrocatalysts Based on Tantalum Phosphide	9
Relativistic Density Functional NMR Tensors Analyzed with Spin‐free Localized Molecular Orbitals	9
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On the Catalytic Performance of (ZrO)n (n=1–4) Clusters for CO Oxidation: A DFT Study	9
Cover Feature: Disentangling the Conformational Space and Structural Preferences of Tetrahydrofurfuryl Alcohol Using Rotational Spectroscopy and Computational Chemistry (ChemPhysChem 12/2024)	9
Microkinetic Modelling of Electrochemical Oxygen Evolution Reaction on Ir(111)@N‐Graphene Surface	9
On the Nature of the Out‐of‐Plane Distortions in Subporphyrins	9
Trianglimine‐Mediated Selective Sieving of Cis Isomer from the Mixture of Dihaloethenes: A Combined Molecular Dynamics and DFT Investigation	9
Theoretical Rotational and Vibrational Spectral Data for the Hypermagnesium Oxide Species Mg2O and Mg2O+	9
Computational Modeling: Up‐to‐Date Approaches and Cutting‐Edge Applications from Clusters, Nanostructures to Bulk Systems	9
Thermal Properties of MXenes and Relevant Applications	9
Oxygen‐Induced Dissociation of a Single Water Molecule in Confined 2‐D Layers: A Semiempirical Study	8
A Case Study on the Use of Binding Free Energies to Screen Inhibitors of Human Carbonic Anhydrase II	8
Sustained Synthesis of Ultra‐Long Gold Wires via an Open Microfluidic System	8
Constructing Potential Energy Surface with Correlated Theory for Dipeptides Using Molecular Tailoring Approach	8
Cover Feature: Substituent Effects in π‐Hole Regium Bonding Interactions Between Au(p‐X‐Py)2 Complexes and Lewis Bases: An ab initio Study (ChemPhysChem 8/2022)	8
Front Cover: Development of a Core–Shell Heterojunction TiO2/SrTiO3 Electrolyte with Improved Ionic Conductivity (ChemPhysChem 11/2022)	8
Evidence for the O−H⋅⋅⋅O=C Resonance‐Assisted Hydrogen Bond in Tropolones and Quantification of its σ‐ and π‐Components Using Molecular Tailoring Approach	8
Strategies and Challenges of Utilizing Cation Effects in Membrane Electrode Assemblies for CO2 Reduction	8
Porous Mn2+ Magnet with a Pt−Cl Framework: Correlation between Water Vapor Adsorption/Desorption and Slow Magnetic Relaxation	8
Exhaustive Conformational Search for Sialyl Cation Reveals Possibility of Remote Participation of Acyl Groups	8
Computational Energy Spectra of the H2O@C70 Endofullerene	8
Photophysics of Benzoxazole and Dicyano Functionalised Diketopyrrolopyrrole Derivatives: Insights into Ultrafast Processes and the Triplet State	8
Photophysical and Photoelectrochemical Properties of CsPbBr3 Films Grown by Electrochemically Assisted Deposition	8
Cover Feature: Vibrationally Resolved Inner‐Shell Photoexcitation of the Molecular Anion C2− (ChemPhysChem 11/2023)	8
Fe‐Doped CoS2 Nanoarrays: Efficient Electrocatalytic Nitrate Reduction to Ammonia under Ambient Conditions	8
Azo‐Cyanamide Bridged Dinuclear Iron Complexes Exhibiting no Electronic Coupling but Moderate Magnetic Coupling between the two Iron Centers	8
Hydrogen Peroxide‐Induced Overoxidation of Fe−N−C Catalysts: Implications for ORR Activity	8
Regulating Efficient and Selective Single‐atom Catalysts for Electrocatalytic CO2 Reduction	8
Investigating the Role of UiO‐68 Supported N‐Heterocyclic Carbene‐Based Metal‐Hydrides for CO Hydrogenation to Methanol	8
Ab Initio Study of H‐Bond Dynamics in Three‐Component Crystals Comprising (DABCOH+)n Polycationic Chains	8
Concentration‐Gradient Structural LiFe0.5Mn0.5PO4/C Prepared via Co‐precipitation Reaction for Advanced Lithium‐Ion Batteries	8
Approaching the Lower Temporal Limit of Laser‐Produced Plasma Sources for Table‐Top Soft X‐Ray NEXAFS Measurements	8
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Lutidyl Radical Photoelectron Spectra Reveal Additive Substituent Effects on Benzyl Derivatives’ Ionization Energy	8
Post‐CCSD(T) Thermochemistry of Chlorine Fluorides as a Challenging Test Case for Evaluating Density Functional Theory and Composite Ab Initio Methods	8
Cover Feature: Combining Open‐Shell Verdazyl Environment and Co(II) Spin‐Crossover: Spinmerism in Cobalt Oxoverdazyl Compound (ChemPhysChem 9/2022)	8
Confinement Dynamics of Nanodroplets between Two Surfaces: Effects of Wettability and Electric Field	8
Capturing the Polarization Response of Solvated Proteins under Constant Electric Fields in Molecular Dynamics Simulations	8
The Influence of Deuterium Isotope Effects on Structural Rearrangements, Ensemble Equilibria, and Hydrogen Bonding in Protic Ionic Liquids	8
Prediction of the Phase Composition Profile of Three‐Compound Mixtures in Liquid‐Liquid Equilibrium: A Chemoinformatics Approach	8
Predicting 195Pt NMR Chemical Shifts in Water‐Soluble Inorganic/Organometallic Complexes with a Fast and Simple Protocol Combining Semiempirical Modeling and Machine Learning	8
Recent Progress on CoP as Anodes for Metal–Ion Batteries	8
Electron interaction with DNA constituents in aqueous phase	8
NMR Self‐Diffusion and Transverse Relaxation Time in Bitumen: The Effect of Aging	8
The Negative Solvatochromism of Reichardt‘s Dye B30 – A Complementary Study	8
Statistically Derived Proxy Potentials Accelerate Geometry Optimization of Crystal Structures	8
Methyl Red Adsorption on Biochar Obtained by Physical Activation of Caraway Seeds with Carbon Dioxide	8
Photoinduced Anisotropy in Thin Films of Azobenzene‐Containing Liquid Crystalline Supramolecular Complexes of Various Polymer Architecture	8
Phase Diagrams of Anthracene Derivatives in Pyridinium Ionic Liquids	8
The Effect of Pulling and Twisting Forces on Chameleon Sequence Peptides**	8
Cover Feature: Dynamics of Citrate Coordination on Gold Nanoparticles Under Low Specific Power Laser‐Induced Heating (ChemPhysChem 7/2023)	8
High Sensitivity Stimulated Raman Scattering Microscopy with Electronic Resonance Enhancement	8
Frequency‐Selective Manipulations of Spins allow Effective and Robust Transfer of Spin Order from Parahydrogen to Heteronuclei in Weakly‐Coupled Spin Systems	8
Cover Feature: Catalytic Deactivation and Regeneration of Nickel Microparticles in a Home‐Built Microchannel‐Coupled Millireactor: Substrate Specificity and Multiphase Flow Dependency (ChemPhysChem 14	8
Photoionization, Structures, and Energetics of Na‐Doped Formic Acid–Water Clusters	8
Dealloying Synthesis of Silicon Nanotubes for High‐Performance Lithium Ion Batteries	8
Binding Energy Partition of Promising IRAK‐4 Inhibitor (Zimlovisertib) for the Treatment of COVID‐19 Pneumonia	8
Low‐Viscosity Concentrated Lithium Chloride Solution with Unsymmetrical Ditopic Receptors in Organic Solvents	8
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)	8
Optimizing Extended Tight‐Binding Methods for Metal‐Surface Interactions	8
Resonances at Fundamental and Harmonic Frequencies for Selective Imaging of Sine‐Wave Illuminated Reversibly Photoactivatable Labels	7
Cover Feature: Self‐Consistent Convolutional Density Functional Approximations: Application to Adsorption at Metal Surfaces (ChemPhysChem 10/2024)	7
Stoichiometric‐Ratio‐Controlled Fe and Ni Non‐Noble Metal Catalysts Supported on γ‐Al2O3 for Turquoise Hydrogen and Carbon Nanotubes Production	7
Structure Formation in the Wetting Layer of a Carbonyl‐Functionalized Ionic Liquid on Au(111): How to Control the Functional Group?	7
Embarking on a New Journey	7
Front Cover: Adsorption of CO on α‐Al2O3(0001): A Combined Experimental and Computational Study (ChemPhysChem 10/2025)	7
Chromogenic Chemosensor for Simultaneous Detection of PO43− and CO32− Anions in Organo‐Aqueous Solutions: Application in Arduino Based Electronic Color Sens	7
Front Cover: Effects of the Nature of Metal Ion, Protein and Substrate on the Catalytic Center in Matrix Metalloproteinase‐1: Insights from Multilevel MD, QM/MM and QM Studies (ChemPhysChem 4/2022)	7
Ag‐Doped Free‐Standing 2D TiO2 Sheets: Electronic, Optical, Magnetic, and Self‐Healing Behaviour	7
Front Cover: Synthesis of Multi‐Functional Graphene Monolayers via Bipolar Electrochemistry (ChemPhysChem 16/2024)	7