ChemPhysChem

Article	Citations
Unusual Solvatofluorochromism of the Asymmetrically Substituted Aromatic Acetylene Derivative CNAacDMA**	78
Reversible Entropy‐Driven Defect Migration and Insulator‐Metal Transition Suppression in VO2 Nanostructures for Phase‐Change Electronic Switching	70
Cover Feature: Exploring the Potential of Multinuclear Solid‐State 1H, 13C, and 35Cl Magnetic Resonance To Characterize Static and Dynamic Disorder in Pharmaceutical H	69
Reverse Intersystem Crossing of Single Deuterated Perylene Molecules in a Dibenzothiophene Matrix	65
Theoretical Screening of Transition Metal Doped Defective MoS2 as Efficient Electrocatalyst for CO Conversion to CH4	57
Transitions of Collective Motions Driven by Phase Resetting	50
Effects of Heavy Iodine Atoms and π‐Expanded Conjugation on Charge Transfer Dynamics in Carboxylic Acid BODIPY Derivatives as Triplet Photosensitizers	39
Cooperative Chemotaxis of Magnesium Microswimmers for Corrosion Spotting	39
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Front Cover: DFT and IsoStar Analyses to Assess the Utility of σ‐ and π‐Hole Interactions for Crystal Engineering (2/2021)	37
Front Cover: Experimental and Theoretical Structure Elucidation of the [2 : 1] Complex Ion of Carbo[n]helicene with n=6, 7 and 8 and Ag+ (ChemPhysChem 21/2023)	34
A Reactive Molecular Dynamics Study of Chlorinated Organic Compounds. Part II: A ChemTraYzer Study of Chlorinated Dibenzofuran Formation and Decomposition Processes	34
Quantum Chemistry in Solution: Fiftieth Anniversary	33
Front Cover: Dissociation of N2 on a Si(111)‐7x7 Surface at Room Temperature (ChemPhysChem 15/2023)	32
Theoretical Design of an MoxW1‐xS2/Graphene (x=0.25/0.75) Heterojunction with Adjustable Band Gap: Potential Candidate Materials for the Next Generation of Optoelectro	31
Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods	30
Photochemical Reaction Mechanism of Intramolecular H Transfer Reaction of H2C3O+⋅ Radical Cation	27
Micro‐ and Nanoscale Heterogeneities in Zeolite Beta as Measured by Atom Probe Tomography and Confocal Fluorescence Microscopy	26
Inorganic Bergman Cyclization: An Appeal From Theory	26
Understanding the Deactivating/Activating Mechanisms in Three Optical Chemosensors Based on Crown Ether with Na+/K+ Selectivity Using Quantum Chemical Tools	25
Boron Tunneling in the “Weak” Bond‐Stretch Isomerization of N−B Lewis Adducts	24
Hexylation Stabilises Twisted Backbone Configurations in the Prototypical Low‐Bandgap Copolymer PCDTBT	23
Can Counter‐Intuitive Halogen Bonding Be Coulombic?	23
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Elucidating the Mechanism of Simultaneous Activation of CH4 and CO2 Mediated by Single Group 10 Metal Anions in Gas Phase	22

Cover Feature: Photochemical Hydrogen Storage with Hexaazatrinaphthylene (ChemPhysChem 11/2022)	22
Catalytic Deactivation and Regeneration of Nickel Microparticles in a Home‐Built Microchannel‐Coupled Millireactor: Substrate Specificity and Multiphase Flow Dependency	22
Disentangling Excimer Emission from Chiral Induction in Nanoscale Helical Silica Scaffolds Bearing Achiral Chromophores	22
Time‐Dependent Hydrogen Bond Network Formation in Glycerol‐Based Deep Eutectic Solvents	21
Dissociative Excitation of Nitromethane Induced by Electron Impact in the Ultraviolet – Visible Spectrum	21
Radiolytic Approach for Efficient, Selective and Catalyst‐free CO2 Conversion at Room Temperature	20
Simultaneous Broadband Suppression of Homonuclear and Heteronuclear Couplings in 1H NMR Spectroscopy	20
Ethanol Oxidation Reaction Mechanism on Gold Nanowires from Density Functional Theory	19
Cover Feature: Energetics of Sulfur‐Carbon Interaction (ChemPhysChem 24/2022)	19
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Front Cover: Binding Energy Partition of Promising IRAK‐4 Inhibitor (Zimlovisertib) for the Treatment of COVID‐19 Pneumonia (ChemPhysChem 24/2022)	18
Cover Feature: Low‐boiling Point Perfluorocarbon Nanodroplets as Dual‐Phase Dual‐Modality MR/US Contrast Agent (ChemPhysChem 24/2022)	18
Statistical Equivalence of Quantum Chemical Methods for Energy Distribution in Water Clusters	18
Cover Feature: Understanding the Surprising Oxidation Chemistry of Au−OH Complexes (ChemPhysChem 1/2023)	18
Force Dependent Barriers from Analytic Potentials within Elastic Environments	18
Front Cover: Relativistic Density Functional NMR Tensors Analyzed with Spin‐free Localized Molecular Orbitals (ChemPhysChem 1/2023)	18
Front Cover: Anion‐Dependent Outstanding Luminescence Enhancement of Eu(D‐facam)3 Upon Coexistence With the Tetramethylammonium Cation (ChemPhysChem 24/2021)	18
Photoelectron Photoion Coincidence Spectroscopy of NCl3 and NCl2	17
Chemical Processes Involving 18‐Crown‐6‐Ether in Activated Noncovalent Complexes with Protonated Peptides	17
Anion‐Dependent Outstanding Luminescence Enhancement of Eu(D‐facam)3 Upon Coexistence With the Tetramethylammonium Cation	17
Front Cover: Controlling Light‐Induced Proton Transfer from the GFP Chromophore (ChemPhysChem 9/2021)	16
Front Cover: The Cytotoxic Effect of α‐Synuclein Aggregates (6/2021)	16
Structural Investigation of Small Nickel‐Ethanol Clusters Using Vibrational Spectroscopy in a Molecular Beam	16
Infrared and NMR Spectroscopic Fingerprints of the Asymmetric H7+O3 Complex in Solution	16
Efficient Interrogation of the Kinetic Barriers Demarcating Catalytic States of a Tyrosine Kinase with Optimal Physical Descriptors and Mixture Models	16
Front Cover: Structure and Conformation of Individual Molecules upon Adsorption of a Mixture of Benzoporphyrins on Ag(111), Cu(111), and Cu(110) Surfaces (ChemPhysChem 17/2023)	16
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In situ Gel Electrolytes for the Interfacial Regulation of Lithium Metal Batteries	16
Development and Application of a Complete Active Space Spin‐Orbit Configuration Interaction Program Designed for Single Molecule Magnets	15
A Direct NMR Method To Measure Self‐Diffusion Coefficients in Liquids by Monitoring Diffusing Molecules through One‐Dimensional Imaging	15
The Importance of Spin‐Polarized Charge Reorganization in the Catalytic Activity of D‐Glucose Oxidase	15
Dielectric Spectroscopy Can Predict the Effect of External AC Fields on the Dynamic Adsorption of Lysozyme	15
The Importance of Spin‐Polarized Charge Reorganization in the Catalytic Activity of D‐Glucose Oxidase	15
Cucurbit[6]uril Hyperpolarized Chemical Exchange Saturation Transfer Pulse Sequence Parameter Optimization and Detectability Limit Assessment at 3.0T	14
Catalytically Active CoSe2 Supported on Nitrogen‐Doped Three Dimensional Porous Carbon as a Cathode for Highly Stable Lithium‐Sulfur Battery	14
Branching‐Chain Propagation of Parahydrogen‐Derived Nuclear Spin Order on a Catalyst Surface	14
Monitoring the Light‐induced Isomerisation of the Prototypical Polycyclic Aromatic Hydrocarbons C10H8+ through Ion‐Molecule Reactions	14
Magnetic Resonance Detection of Gas Microbubbles via HyperCEST: A Path Toward Dual Modality Contrast Agent	14
Laser‐Assisted Synthesis of Non‐Equilibrium Nanoalloys	14
London Dispersion Effects on the Structure and Properties of Nonlinear Optical BiB3O6 Crystal	13
Estimate of the C−Cl photoionization cross section and absolute photoionization cross sections of chlorinated organic compounds	13
Composites with Immobilized Bioactive Spirulina on an Inorganic Substrate (Yellow Clay, Hydroxyapatite, SiO2, TiO2, ZnO)	13
The Hunter Falls Prey: Photoinduced Oxidation of C60 in Inclusion Complex with Perfluorocycloparaphenylene	13
Visible‐light‐driven Oxygen Vacancy and Carbon Doping of C@TiO2‐x Photocatalyst for Enhanced Pollutants Degradation Performance	12
Thermally and Optically Activated Migration of Charge Carriers in Alkali Metal Sesquioxides	12
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Cover Feature: Revealing the Mechanistic Features of an Electrosynthetic Catalytic Reaction and the Role of Redox Mediators through DFT Calculations and Microkinetic Modeling (ChemPhysChem 15/2024)	12
Molecular Dynamics Simulations of Nitric Oxide Scattering Off Graphene	12
A Magnetocaloric Glass from an Ionic‐Liquid Gadolinium Complex	12
Structural, Electronic, and Optical Properties of Hexagonal XC6 (X=N, P, As, and Sb) Monolayers	12

Impact of the Acetyl Group on Cysteine: A Study of N‐Acetyl‐Cysteine through Rotational Spectroscopy	12
Neuromorphic Liquids, Colloids, and Gels: A Review	12
Benzenetriimide‐Based Molecular Conductor with Antiferro‐ to Ferromagnetic Switching Induced by Structural Change of π‐stacked Array	12
Comparison of Structural, Water‐Retaining and Sorption Properties of Acrylamide‐Based Hydrogels Cross‐Linked by Physical and Chemical Methods	12
Polymer Electrochemiluminescence Featuring Thermally Activated Delayed Fluorescence	12
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The Effect of Fluorinated Solvents on the Physicochemical Properties, Ionic Association, and Free Volume of a Prototypical Solvate Ionic Liquid	11
Front Cover: Nano‐Optical Tweezers: Methods and Applications for Trapping Single Molecules and Nanoparticles (ChemPhysChem 14/2021)	11
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Quantum Chemistry and Pharmacy: Diagnostic Check of the Thermochemistry of Ibuprofen	11
Cover Feature: Adiabat‐to‐Diabat Angle in Seam Space: Renner‐Teller‐Type and Pseudo‐Jahn‐Teller‐Type Problems (ChemPhysChem 11/2024)	11
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Cover Feature: Rational Development of a Metal‐Free Bifunctional System for the C−H Activation of Methane: A Density Functional Theory Investigation (ChemPhysChem 19/2021)	11
Insight Into The Spin‐Vibronic Problem of a Mixed Valence Magnetic Molecular Cell for Quantum Cellular Automata	11
Structure‐Guided Evolution of Cyclohexanone Monooxygenase Toward Bulky Omeprazole Sulfide: Substrate Migration and Stereoselectivity Inversion	11
Front Cover: Formation of Temporary Negative Ions and Their Subsequent Fragmentation upon Electron Attachment to CoQ0 and CoQ0H2 (ChemPhysChem 5/2022)	11
Understanding the Molecular Origin of the Collective Movement in a Diarylethene‐based Photo‐Responsive Actuator	11
Quantification of the Donor‐Acceptor Character of Ligands by the Effective Fragment Orbitals	11
Cover Feature: Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy (ChemPhysChem 11/2024)	11
Strength and Nature of Host‐Guest Interactions in Metal‐Organic Frameworks from a Quantum‐Chemical Perspective	10
Comparative Hydrophobic Core Dynamics Between Wild‐Type Amyloid‐β Fibrils, Glutamate‐3 Truncation, and Serine‐8 Phosphorylation	10
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Tunable Gas‐Gas Reactions through Nanobubble Pathway	10
Aza‐Michael Addition in Explicit Solvent: A Relative Energy Gradient–Interacting Quantum Atoms Study	10
The Resting Oxidized State of Small Laccase Analyzed with Paramagnetic NMR Spectroscopy	10
New Luminescent Lanthanide Tetrakis‐Complexes NEt4[LnL4] Based on Dimethyl‐N‐Benzoylamidophosphate	10
Doping‐Induced Enhancement of Hydrogen Evolution at MoS2 Electrodes	10
A nuclear configuration interaction approach to study nuclear spin effects: an application to ortho‐ and para‐3He2@C60	10
Unfurling Anion‐π Interactions Involving Graphynes	10
Front Cover: Critical Assessment of pH‐Dependent Lipophilicity Profiles of Small Molecules: Which One Should We Use and In Which Cases? (ChemPhysChem 24/2023)	10
Redox Properties and in Vivo Magnetic Resonance Imaging of Cyclodextrin‐Polynitroxides Contrast Agents	10
Understanding the Target Search by Multiple Transcription Factors on Nucleosomal DNA	10
Disentangling Acid‐Base Chemistry through Blue Shifting Hydrogen Bond Contributions	10
Probing the Electronic Structure of Prussian Blue and Analog Films by Photoemission and Electron Energy Loss Spectroscopies	10
Electrografting of Carbon Surfaces with Aliphatic Chains and its Effect on the Rectification of Ferrocene as Redox Probe in Solution	10
Critical Assessment of pH‐Dependent Lipophilicity Profiles of Small Molecules: Which One Should We Use and In Which Cases?	10
Value Added Conversion of Ethanol on Morphologically Controlled and Defect‐Engineered Titanium Dioxide Nanorods	10
Cover Feature: A Photoswitchable Solvatochromic Dye for Probing Membrane Ordering by RESOLFT Super‐resolution Microscopy (ChemPhysChem 12/2023)	9
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Cover Feature: Cation Co‐intercalation in Potassium Copper(II) Hexacyanoferrates (ChemPhysChem 9/2023)	9
Front Cover: Transitions of Collective Motions Driven by Phase Resetting (ChemPhysChem 12/2023)	9
Revisiting the TCNQF40/1−/2− Catalysis Mechanism for the [Fe(CN)6]3−/4−‐S2O32−/S4O62− Redo	9
Acetylene‐Mediated Borophosphene Dirac Materials as Efficient Anode Materials for Lithium‐Ion Batteries	9
A DFT Investigation of B‐Doped C3N as Single Atom Electrocatalysts for N2‐to‐NH3 Conversion	9
Hyperpolarization of cis‐15N2‐Azobenzene by Parahydrogen at Ultralow Magnetic Fields**	9
Competition between Inter and Intramolecular Tetrel Bonds: Theoretical Studies Complemented by CSD Survey	9
Cover Feature: Laser Photoreduction of Graphene Aerogel Microfibers: Dynamic Electrical and Thermal Behaviors (ChemPhysChem 23/2022)	9
Organometallic Allene [(μ‐C)(Fe(CO)4)2]: Bridging Carbon Showing Transformation from Classical Electron‐Sharing Bonding to Double σ‐Donor and Double π‐Acceptor Ligation	9
Electronic Structure and Magnetic Properties of a High‐Spin MnIIIComplex: [Mn(mesacac)3] (mesacac=1,3‐Bis(2,4,6‐trimethylphenyl)‐propane‐1,3‐dionato)	9
Front Cover: Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al) (ChemPhysChem 10/2023)	9
Unveiling the Noncovalent Interaction of Thiazol‐2‐ylidene and Its Derivatives as N‐heterocyclic Carbene with Different Proton Donor Molecules	9
Near Infrared Light‐to‐Heat Conversion for Liquid‐Phase Oxidation Reactions by Antimony‐Doped Tin Oxide Nanocrystals	9
Effects of Intra‐Base Pair Proton Transfer on Dissociation and Singlet Oxygenation of 9‐Methyl‐8‐Oxoguanine−1‐Methyl‐Cytosine Base‐Pair Radical Cations	9
Electronic Properties of Transition and Alkaline Earth Metal Doped CuS: A DFT Study	9
Cover Feature: Optical Physical Mechanisms of Helicene Carbon Nanohoop with Möbius Topology (ChemPhysChem 8/2023)	9
Front Cover: Reentrant 2D Nanostructured Liquid Crystals by Competition between Molecular Packing and Conformation: Potential Design for Multistep Switching of Ionic Conductivity (ChemPhysChem 8/2023)	9
Front Cover: Revisiting the TCNQF40/1−/2− Catalysis Mechanism for the [Fe(CN)6]3−/4−‐S2O32−/S4O6	9
Cover Feature: Theoretical Study of the Hydroxyl‐Radical‐Initiated Degradation Mechanism, Kinetics, and Subsequent Evolution of Methyl and Ethyl Iodides in the Atmosphere (ChemPhysChem 10/2023)	9
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Cover Feature: Increasing Complexity in Adamantyl Thioethers Characterized by Rotational Spectroscopy (ChemPhysChem 23/2023)	9
Comparison of the Ability of N‐Bases to Engage in Noncovalent Bonds	9
Front Cover: Efficient Direct Reverse Intersystem Crossing between Charge Transfer‐Type Singlet and Triplet States in a Purely Organic Molecule (7/2021)	9
Theoretical Chemistry Symposium 2021	9
A Curious Case of Two‐Photon Absorption in n‐Helicene and n‐Phenylene, n=6–10: Why n=7 is Different?	8
NMR Study of CO2 Capture by Butylamine and Oligopeptide KDDE in Aqueous Solution: Capture Efficiency and Gibbs Free Energy of the Capture Reaction as a Function of pH**	8
Rational Control of Off‐State Heterogeneity in a Photoswitchable Fluorescent Protein Provides Switching Contrast Enhancement**	8
Capacitive Impedance for Following In‐Situ Grafting Kinetics of Diazonium Salts	8
Ab Initio Molecular Dynamics Study of H2 Dissociation Mechanisms on Cu13 and Defective Graphene‐supported Cu13 Clusters: Active Sites, Energy Barriers and Adsorption S	8
Reverse Dual‐Ion Battery Enabled by Reversing the Cation/Anion Storage Mechanism in an Aqueous ZnCl2 Water‐in‐Salt Electrolyte	8
Understanding the Behaviour of Real Metaborates in Solution	8
From Ligand‐ to Metal‐centered Reactivity: Metal Substitution Effect in Thiosemicarbazone‐based Complexes for H2 Production	8
Ligand Effect on Physicochemical Properties of Ionic Liquid	8
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Identification of Electrochemically Adsorbed Species via Electrochemical Microcalorimetry: Sulfate Adsorption on Au(111)	8
Heavy‐Atom‐Free Bay‐Substituted Perylene Diimide Donor‐Acceptor Photosensitizers	8
Front Cover: An Algebraic Blueprint for Predicting Turnover Numbers and Endpoints in Photocatalysis (ChemPhysChem 3/2024)	8
Exploiting Phase Transitions in Catalysis: Adsorption of CO on doped VO2‐Polymorphs	8
Voltammetric Behaviour of LMO at the Nanoscale: A Map of Reversibility and Diffusional Limitations	8
Photoactive Zr and Ti Metal‐Organic‐Frameworks for Solid‐State Solar Cells	8
Towards Nematic Phases in Ionic Liquid Crystals – A Simulation Study	8

Cation Co‐intercalation in Potassium Copper(II) Hexacyanoferrates	8
Front Cover: The Steady‐State ALTADENA RASER Generates Continuous NMR Signals (ChemPhysChem 14/2023)	8
Spatial and Electronic Structures of BeB8 and MgB8: How far Does the Analogy Go?	8
The Steady‐State ALTADENA RASER Generates Continuous NMR Signals	8
Indirect Nuclear Spin‐Spin Exchange Coupling through Solvated Electron in Small Sizes of Cyclic and Cage‐Shaped Perfluoroalkanes	8
Accurate Geometry and Non‐Covalent Interactions in 1‐Phenylethanol and its Monohydrate: A Rotational Study	8
A Rotational Study of 2‐tert‐Butylphenol and Its 1 : 1 Argon Complex	8
Aromaticity of ortho and meta 8‐Cycloparaphenylene and Their Dications: Induced Magnetic Field Analysis with Localized and Delocalized Orbitals in Strained Nanohoops	8
ZrN6‐Doped Graphene for Ammonia Synthesis: A Density Functional Theory Study	8
Effects of Ionic Liquids on the Thermodynamics of Hydrogen Activation by Frustrated Lewis Pairs: A Density Functional Theory Study**	8
Cover Feature: Rare Spin Avoided σ‐σ Diradical Planar Tetracoordinate Boron Cluster: A Proto‐Star for Planar Pentacoordination (ChemPhysChem 18/2023)	8
Effects of Conjugated Structure on the Magnesium Storage Performance of Dianhydrides	8
High‐level ab initio evidence of bipyramidal Cu5 clusters as fluxional Jahn‐Teller molecules	8
Combined Modelling of Triply Paired Electronic States of HO2+ ion with 3 Symmetry using Coupled Eigen Model	8
Cover Feature: Background‐Free Detection of Spin‐Exchange Dynamics at Ultra‐Low Magnetic Field (ChemPhysChem 19/2023)	8
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Theoretical study of NH3, H2S, and HCN adsorption enhancement on defective graphene‐supported Cu19 clusters	8
Photo‐Responsive Behavior of Azobenzene Based Polar Hockey‐Stick‐Shaped Liquid Crystals	8
On the Role of Amides and Imides for Understanding GaN Syntheses from Ammonia Solution: Molecular Mechanics Models of Ammonia, Amide and Imide Interactions with Gallium Nitride	8
CO Oxidation on Planar Au/TiO2 Model Catalysts under Realistic Conditions: A Combined Kinetic and IR Study	8
Ni‐Ti Intercalated and Supported Bentonite for Selective Hydrogenation of Cinnamaldehyde	8
Dissociation of N2 on a Si(111)‐7x7 Surface at Room Temperature	8
Color Polymorphism and Room Temperature Phosphorescence of 4‐Bromo‐2,7‐Di‐Tert‐Butyl‐ 9‐Methoxypyrene	8
Insights and Activation Energy Surface of the Dehydrogenation of C2HxO Species in Ethanol Oxidation Reaction on Ir(100)	8
An Algebraic Blueprint for Predicting Turnover Numbers and Endpoints in Photocatalysis	8
Intermediate Intercluster Bond Orders. Electronic Communication in Au38(SR)24 Superatomic Molecules	7
Ligand 1H NMR Chemical Shifts as Accurate Reporters for Protein‐Ligand Binding Interfaces in Solution**	7
Exploring the Impact of Protein Chain Selection in Binding Energy Calculations with DFT	7
Electronic and Nonlinear Optical Properties of B(III)‐Submonoazaporphyrin‐π‐Diimide Compounds: A Density Functional Theory Study	7
Actinide‐Actinide Bonding: Electron Delocalisation and σ‐Aromaticity in the Tri‐Thorium Cluster [{Th(η8‐C8H8)(μ‐Cl)2}3K2]	7
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From Lithium and Sodium Superoxides to Singlet‐Oxygen – Insights into the Mechanism of Dissociation Using SHARC‐MD	7
Activation and Conversion of Molecular Nitrogen to the Precursor of Ammonia on Silicon Substituted Cyclo[18]Carbon: a DFT Design	7
Molecular Oxygen Trimer: Multiplet Structures and Stability	7
Platinum‐Iridium Alloy Nanoparticle Coatings Produced by Electrophoretic Deposition Reduce Impedance in 3D Neural Electrodes	7
Mesoporous Metal Sponges Produced by Explosive Decomposition	7
Photobleaching Kinetics and Effect of Solvent in the Photophysical Properties of Indocyanine Green for Photodynamic Therapy	7
Dealloying Synthesis of Silicon Nanotubes for High‐Performance Lithium Ion Batteries	7
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The Special Case of the Spectral Emission of a Tb3+ Mono Metal Complex	7
Cu(I) Coordination Compounds Conjugated to Au Nanorods for Future Applications in Drug Delivery: Insights in Molecular, Electronic and Cu Local Structure in Solid and Liquid Phase	7
Role of Hydrogen Bond Defects for Cluster Formation and Distribution in Ionic Liquids by Means of Neutron Diffraction and Molecular Dynamics Simulations	7
Front Cover: Wireless Multimodal Light‐Emitting Arrays Operating on the Principles of LEDs and ECL (ChemPhysChem 12/2024)	7
Nanobubbles in Ultrapure Water Can Self‐Propel	7
Stand up for Electrostatics: The Disiloxane Case	7
A Benchmark Study of DFT‐Computed p‐Block Element Lewis Pair Formation Enthalpies Against Experimental Calorimetric Data	7
Optimizing the Photovoltaic Performance of Organic Solar Cells for Indoor Light Harvesting	7
Kinetic Monte Carlo Simulations of Low‐Temperature NH3‐SCR over Cu‐Exchanged Chabazite	7
N, S Co‐Doped Carbon Nanotubes Loaded With Cu Nanoclusters For Efficient Oxygen Reduction Reaction	7
An Ensemble Structure and Physicochemical (SPOC) Descriptor for Machine‐Learning Prediction of Chemical Reaction and Molecular Properties	7
Elaborating the Fluorescence Regulation and Quenching Mechanism of Sulfur‐for‐Oxygen Replacement for Fluorophores	7
Photophysics of Hydrophobic Corroles in the Aqueous Micellar Media and in the Presence of Graphene Oxide and Bioanalytes	7
Potential‐Dependent Pt(111)/Water Interface: Tackling the Challenge of a Consistent Treatment of Electrochemical Interfaces**	7
Synthesis and Characterization of N‐Doped Carbon Quantum Dots and its Application for Efficient Delivery of Curcumin in Live Cell	7
New Insights in the Computational pKb Determination of Primary Amines and Anilines	7
Preferred Electric Field Mechanism for Frustrated Lewis Pair Reactivity	7
To Be or Not To Be? that is the Entropic, Enthalpic, and Molecular Interaction Dilemma in the Formation of (Water)20Clusters and Methane Clathrate	7
Dynamics of pH Oscillators in Continuous Stirred Tanks in Series	7
Absorption and Excited‐State Coherences of Cryogenically Cold Retinal Protonated Schiff Base in Vacuo	7
Improved Conductivity and in Situ Formed Heterojunction via Zinc Doping in CuBi2O4 for Photoelectrochemical Water Splitting	7
New Perspectives on Delocalization Pathways in Aromatic Molecular Chameleons	7
Studies on the Process of Basic Dyes Adsorption on Uniform Spherical Carbons	7
Adsorption Mechanism of Benzene Derivatives by Pagoda[n]arenes	7
Electron Attachment to the Nucleobase Uracil in Diethylene Glycol: The Signature of a Doorway	7
The Influence of Large Pendent Groups on Chain Anisotropy and Electrical Energy Loss of Polyimides at High Frequency through All‐Atomic Molecular Simulation	7
Assignment of a Physical Energy Scale for the Dimensionless Interaction Energies within the PRIME20 Peptide Model	7
Twist‐Bend Nematic Glasses: The Synthesis and Characterisation of Pyrene‐based Nonsymmetric Dimers	7
Structure and Dynamics in Solid Electrolyte Composites of the Organic Ionic Plastic Crystal HMGFSI and Lithium Sulphonamide Functional Acrylate Polymer Nanoparticles	7
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Influence of 3D Structural Design on the Electrochemical Performance of Aluminum Metal as Negative Electrode for Li‐Ion Batteries	7
Polysulfide Speciation and Migration in Catholyte Lithium−Sulfur Cells	7
Experimental Elucidation of a Cubane Water Cluster in the Hydrophobic Cavity of UiO‐66	7
Cover Feature: Formation of Methanol via Fischer‐Tropsch Catalysis by Cosmic Iron Sulphide (ChemPhysChem 17/2024)	7
The Electronic Spin State of Diradicals Obtained from the Nuclear Perspective: the Strange Case of Chichibabin Radicals	7
Velocity Map Imaging Photoelectron Spectroscopy of Silver Iodide Aerosol Particles	7
Rotational Spectroscopy of 2‐Furoic Acid and Its Dimer: Conformational Distribution and Double Proton Tunneling	7
Oxygen Adsorption, Absorption and Diffusion in FeCrNi Medium Entropy Alloy: An Ab Initio Study	7
Homogeneous Dephasing in Photosynthetic Bacterial Reaction Centers: Time Correlation Function Approach	7
Ring‐polymer Molecular Dynamics Simulation for the Adsorption of H2 on Ice Clusters (H2O)n (n=8, 10, and 12)	7
Phosphide‐Based Electrocatalysts for Urea Electrolysis: Recent Trends and Progress	7
Global Potential Energy Surfaces by Compressed‐State Multistate Pair‐Density Functional Theory for Hyperthermal Collisions in the O2+O2 System	7
The Configuration Identification of Guanine Molecules Adsorbed on the Si(100) Surface by Using XPS Shake‐up Satellites and NEXAFS	7
Adducing Knowledge Capabilities of Instrumental Techniques Through the Exploration of Heterostructures’ Modification Methods	7
Evaluating Quinolines: Molecular Dynamics Approach to Assess Their Potential as Acetylcholinesterase Inhibitors for Alzheimer's Disease.	6
Nonadiabatic Photodynamics of Amantadine and 1‐Cyanoadamantane Cations	6
Cages versus Sheets: A Critical Comparison in the Size Range Expected for Methylaluminoxane (MAO)	6
Piezoelectric Materials and Pyroelectric Materials:High Efficient Catalysts for Photoelectrochemical Water Splitting	6
Kinetics and Dynamics of Cyclopentanone Thermal Decomposition in Gas Phase	6
Electrocatalytic and Photocatalytic Reduction of Carbon Dioxide by Earth‐Abundant Bimetallic Molecular Catalysts	6
Low‐Temperature Thermal Formation of the Cyclic Methylphosphonic Acid Trimer [c‐(CH3PO2)3]	6
Modeling Small Structural and Environmental Differences in Solids with 15N NMR Chemical Shift Tensors	6
Quantitative Characterization of Fluorine‐Centered Noncovalent Interactions in Crystalline Benzanilides	6
Se‐Doping on Co4S3 Cathode Based on Soft Anion Chemistry to Enhance Magnesium Storage Performance	6
The Bond Energy of the Carbon Skeleton in Polyaromatic Halohydrocarbon Molecules	6
Semiclassical Trajectory Studies of Reactive and Nonreactive Scattering of OH(A2Σ+) by H2 Based on an Improved Full‐Dimensional Ab Initio Diabatic Potential Ene	6