Works matching IS 14394235 AND DT 2023 AND VI 24 AND IP 10

Results: 23

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).

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300021

By:

Liu, Xiang‐Huan;
Bai, Feng‐Yang;
Meng, Ting‐Ting;
Ni, Shuang;
Zhao, Zhen

Publication type:

Article

Cover Feature: Ring‐polymer Molecular Dynamics Simulation for the Adsorption of H2 on Ice Clusters (H2O)n (n=8, 10, and 12) (ChemPhysChem 10/2023).

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200939

By:

Murakami, Tatsuhiro;
Ogino, Kanon;
Hashimoto, Yu;
Takayanagi, Toshiyuki

Publication type:

Article

Front Cover: Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al) (ChemPhysChem 10/2023).

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300278

By:

Moritz, Philipp;
Höfft, Oliver;
Wegewitz, Lienhard;
Maus‐Friedrichs, Wolfgang

Publication type:

Article

Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al).

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300076

By:

Moritz, Philipp;
Höfft, Oliver;
Wegewitz, Lienhard;
Maus‐Friedrichs, Wolfgang

Publication type:

Article

Nucleus Independent Chemical Shift (NICS) at Small Distances from the Molecular Plane: The Effect of Electron Density.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300080

By:

Stanger, Amnon

Publication type:

Article

Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al).

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300277

By:

Moritz, Philipp;
Höfft, Oliver;
Wegewitz, Lienhard;
Maus‐Friedrichs, Wolfgang

Publication type:

Article

Exploring Glycosylated Soy Isoflavones Affinities toward G‐tetrads as Studied by Survival Yield Method.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300056

By:

Stężycka, Olga;
Frańska, Magdalena;
Beszterda‐Buszczak, Monika

Publication type:

Article

Theoretical Study of the Hydroxyl‐Radical‐Initiated Degradation Mechanism, Kinetics, and Subsequent Evolution of Methyl and Ethyl Iodides in the Atmosphere.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300021

By:

Liu, Xiang‐Huan;
Bai, Feng‐Yang;
Meng, Ting‐Ting;
Ni, Shuang;
Zhao, Zhen

Publication type:

Article

Statistical Equivalence of Quantum Chemical Methods for Energy Distribution in Water Clusters.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300019

By:

Tokmachev, Andrey M.

Publication type:

Article

Mo Cluster Support on C2N as a Highly‐efficient Catalyst for Electrocatalytic Nitrogen Reduction Reaction.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202300012

By:

Chen, Yuke;
Zhao, Ming;
Wang, Zhili;
Jiang, Qing

Publication type:

Article

Ring‐polymer Molecular Dynamics Simulation for the Adsorption of H2 on Ice Clusters (H2O)n (n=8, 10, and 12).

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200939

By:

Murakami, Tatsuhiro;
Ogino, Kanon;
Hashimoto, Yu;
Takayanagi, Toshiyuki

Publication type:

Article

Time‐resolved, Gas‐phase Kinetic and Quantum Chemical Studies of the Reaction of Germylene with Hydrogen Chloride.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200902

By:

Becerra, Rosa;
Cannady, J. Pat;
Walsh, Robin

Publication type:

Article

Aryl Boronic Acids in Columnar Stacked Co‐crystalline Materials: Key‐Factors Governing the Assembly with Quinones.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200883

By:

Petroselli, Manuel;
Saccone, Marco;
Cametti, Massimo

Publication type:

Article

Theoretical Study on Zigzag Boron Nitride Nanowires.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200813

By:

Li, Feng‐Yin;
Zhang, Jia‐Qi;
Zhang, Hong‐Xing;
Wang, Jian;
Jia, Ran

Publication type:

Article

Ligand Effect on Physicochemical Properties of Ionic Liquid.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200802

By:

Rout, Alok;
Mishra, Satyabrata

Publication type:

Article

Supercritical CO2‐induced New Chemical Bond of C−O−Si in Graphdiyne to Achieve Robust Room‐Temperature Ferromagnetism.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200793

By:

Yang, Jian;
Gao, Bo;
Liu, Wei;
Du, Jiang;
Xu, Qun

Publication type:

Article

Constructing Potential Energy Surface with Correlated Theory for Dipeptides Using Molecular Tailoring Approach.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200784

By:

Khire, Subodh S.;
Gattadahalli, Nandini;
Gurav, Nalini D.;
Kumar, Anmol;
Gadre, Shridhar R.

Publication type:

Article

Revealing the Chemical State of Palladium in Operating In2O3 Gas Sensors: Metallic Pd Enhances Sensing Response and Intermetallic InxPdy Compound Blocks It.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200775

By:

Ovsianytskyi, Oleksandr;
Bekheet, Maged F.;
Gili, Albert;
Gurlo, Aleksander

Publication type:

Article

A Case Study on the Use of Binding Free Energies to Screen Inhibitors of Human Carbonic Anhydrase II.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200770

By:

Khatua, Satyajit;
De Bhowmik, Tanusri;
Taraphder, Srabani

Publication type:

Article

Carbon Dioxide Reduction on Transition Metal Dichalcogenides with Ni and Cu Edge Doping: A Density‐Functional Theory Study.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200765

By:

Kruchinin, Ronen;
Diéguez, Oswaldo

Publication type:

Article

Insights into Nitrogen‐doped Carbon for Oxygen Reduction: The Role of Graphitic and Pyridinic Nitrogen Species.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200734

By:

Wang, Dongliang;
Hu, Jingping;
Wei, Junjie;
Liu, Xianli;
Hou, Huijie

Publication type:

Article

Ni‐Ti Intercalated and Supported Bentonite for Selective Hydrogenation of Cinnamaldehyde.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200703

By:

Xu, Yiyuan;
Su, Tongming;
Luo, Xuan;
Qin, Zuzeng;
Ji, Hongbing

Publication type:

Article

Weak Interactions Initiate C−H and C−C Bond Dissociation of Ethane on Nbn+ Clusters.

Published in:

ChemPhysChem, 2023, v. 24, n. 10, p. 1, doi. 10.1002/cphc.202200530

By:

Gan, Wen;
Huang, Benben;
Cui, Chaonan;
Hansen, Klavs;
Luo, Zhixun

Publication type:

Article

Works matching IS 14394235 AND DT 2023 AND VI 24 AND IP 10

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).

Cover Feature: Ring‐polymer Molecular Dynamics Simulation for the Adsorption of H<sub>2</sub> on Ice Clusters (H<sub>2</sub>O)<sub>n</sub> (n=8, 10, and 12) (ChemPhysChem 10/2023).

Front Cover: Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al) (ChemPhysChem 10/2023).

Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al).

Nucleus Independent Chemical Shift (NICS) at Small Distances from the Molecular Plane: The Effect of Electron Density.

Interaction of Cyanoacrylate with Metal Oxide Surfaces (Cu, Al).

Exploring Glycosylated Soy Isoflavones Affinities toward G‐tetrads as Studied by Survival Yield Method.

Theoretical Study of the Hydroxyl‐Radical‐Initiated Degradation Mechanism, Kinetics, and Subsequent Evolution of Methyl and Ethyl Iodides in the Atmosphere.

Statistical Equivalence of Quantum Chemical Methods for Energy Distribution in Water Clusters.

Mo Cluster Support on C<sub>2</sub>N as a Highly‐efficient Catalyst for Electrocatalytic Nitrogen Reduction Reaction.

Ring‐polymer Molecular Dynamics Simulation for the Adsorption of H<sub>2</sub> on Ice Clusters (H<sub>2</sub>O)<sub>n</sub> (n=8, 10, and 12).

Time‐resolved, Gas‐phase Kinetic and Quantum Chemical Studies of the Reaction of Germylene with Hydrogen Chloride.

Aryl Boronic Acids in Columnar Stacked Co‐crystalline Materials: Key‐Factors Governing the Assembly with Quinones.

Theoretical Study on Zigzag Boron Nitride Nanowires.

Ligand Effect on Physicochemical Properties of Ionic Liquid.

Supercritical CO<sub>2</sub>‐induced New Chemical Bond of C−O−Si in Graphdiyne to Achieve Robust Room‐Temperature Ferromagnetism.

Constructing Potential Energy Surface with Correlated Theory for Dipeptides Using Molecular Tailoring Approach.

Revealing the Chemical State of Palladium in Operating In<sub>2</sub>O<sub>3</sub> Gas Sensors: Metallic Pd Enhances Sensing Response and Intermetallic In<sub>x</sub>Pd<sub>y</sub> Compound Blocks It.

A Case Study on the Use of Binding Free Energies to Screen Inhibitors of Human Carbonic Anhydrase II.

Carbon Dioxide Reduction on Transition Metal Dichalcogenides with Ni and Cu Edge Doping: A Density‐Functional Theory Study.

Insights into Nitrogen‐doped Carbon for Oxygen Reduction: The Role of Graphitic and Pyridinic Nitrogen Species.

Ni‐Ti Intercalated and Supported Bentonite for Selective Hydrogenation of Cinnamaldehyde.

Weak Interactions Initiate C−H and C−C Bond Dissociation of Ethane on Nb<sub>n</sub><sup>+</sup> Clusters.