Works matching IS 14394235 AND DT 2024 AND VI 25 AND IP 16
Results: 31
Cover Feature: Tuning Electronic and Structural Properties of Lead‐Free Metal Halide Perovskites: A Comparative Study of 2D Ruddlesden‐Popper and 3D Compositions (ChemPhysChem 16/2024).
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202481603
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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).
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202481602
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Front Cover: Synthesis of Multi‐Functional Graphene Monolayers via Bipolar Electrochemistry (ChemPhysChem 16/2024).
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202481601
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First‐Principles Insights into the Mechanism of CO<sub>2</sub> Hydrogenation Reactions by Fe‐PNP Pincer Complex.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400425
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Gas‐Responsive and Gas‐Releasing Polymer Assemblies.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400413
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The Heavy Atom Structure, "cis effect" on Methyl Internal Rotation, and <sup>14</sup>N Nuclear Quadrupole Coupling of 1‐Cyanopropene from Quantum Chemical and Microwave Spectroscopic Analysis.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400387
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Stable, while Still Active? A DFT Study of Cu, Ag, and Au Single Atoms at the C<sub>3</sub>N<sub>4</sub>/TiO<sub>2</sub> Interface.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400378
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Theoretical Prediction and Comprehensive Characterization of an All‐Nitrogenatomic Ring, Cyclo[18]Nitrogen (N<sub>18</sub>).
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400377
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Open Circuit Interaction Between Ethanol or 2‐Propanol and Oxidized Platinum Surfaces.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400359
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Self‐Assembly of the Porphyrin Monomer on the Surface of Fe/Graphene Material: A Novel Sensing Material for the Detection of Chloramphenicol Antibiotic in Aqueous solution.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400355
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Reversible Capture Mechanism of CO<sub>2</sub> as a Zn(II)‐Methylcarbonate.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400324
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White Light Emissive Eu(III) Complexes through Ligand Engineering and their Applications in Cool Near Ultraviolet White Light Emitting Diodes and Thermometer.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400320
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Explicit Modelling of Spectral Bandshapes by a Mixed Quantum‐Classical Approach: Solvent Order and Temperature Effects in the Optical Spectra of Distyrylbenzene.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400307
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- Article
Synthesis of Multi‐Functional Graphene Monolayers via Bipolar Electrochemistry.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400257
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- Article
An Eutectic Mixture in the Tetrabutylammonium Bromide‐Octanol System: Macroscopic and Microscopic Points of View.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400219
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Standard Response Calculation of Electric Dipole Polarizability and Specific Optical Rotation Power Densities.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400203
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In situ Low‐Energy Electron Microscopy of Chemical Waves on a Composite V‐oxide/Rh(110) Surface.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400186
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Predicting Emission Spectra of Heteroleptic Iridium Complexes Using Artificial Chemical Intelligence.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400176
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Mechanical Interatomic Bond Formation in Ethanol and Methanol–Ethanol Mixture by Laser‐Driven Shock Waves.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400164
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Determining the Factors Accounting for Reaction Selectivity: A Relative Energy Gradient – Interacting Quantum Atoms and Natural Bonding Orbitals Study.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400163
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Voltage‐Gated Ion Channels: Structure, Pharmacology and Photopharmacology.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400162
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Dimerization of Fe(III) Ion in an Aqueous Medium: Mechanistic Modelling and Effects of Ligands.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400144
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Catalysts with Trimetallic Sites on Graphene‐like C<sub>2</sub>N for Electrocatalytic Nitrogen Reduction Reaction: A Theoretical Investigation.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400143
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Tuning Electronic and Structural Properties of Lead‐Free Metal Halide Perovskites: A Comparative Study of 2D Ruddlesden‐Popper and 3D Compositions.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400118
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Autohesion Mechanisms at Interfaces Between Random Copolymer Melts: Mesoscopic Simulations with Realistic Coarse‐Grained Models.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400114
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When Tautomers Matter: UV‐Vis Absorption Spectra of Hypoxanthine in Aqueous Solution from Fully Atomistic Simulations.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400107
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Structural Order in the Hydration Shell of Nonpolar Groups versus that in Bulk Water.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400102
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Experimental and Theoretical Predictors for Redox Potentials of Bispyridinylidene Electron Donors.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202400092
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Exploring the Scaling Factors for Infrared Modes of PANHs – A Case Study on Cationic 3‐Azafluoranthene⋅<sup>+</sup> and Protonated 3‐Azafluoranthene**.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202300915
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Bayesian Optimization for Efficient Prediction of Gas Uptake in Nanoporous Materials.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202300850
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In‐Situ Lithium Analysis In MgLi Alloys Using Laser‐Induced Breakdown Spectroscopy with a Compact Chamber.
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- ChemPhysChem, 2024, v. 25, n. 16, p. 1, doi. 10.1002/cphc.202300843
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