Works matching IS 14394235 AND DT 2024 AND VI 25 AND IP 11

Results: 26

Front Cover: Prediction of Feasibility of Polaronic OER on (110) Surface of Rutile TiO2 (ChemPhysChem 11/2024)

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400060

By:

Pada Sarker, Hori;
Abild‐Pedersen, Frank;
Bajdich, Michal

Publication type:

Article

Cover Feature: Adiabat‐to‐Diabat Angle in Seam Space: Renner‐Teller‐Type and Pseudo‐Jahn‐Teller‐Type Problems (ChemPhysChem 11/2024).

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400527

By:

Chen, Benny Jun;
Pradhan, Ekadashi;
Nooijen, Marcel;
Zeng, Tao

Publication type:

Article

Cover Feature: Controlling Chirogenic Effects in Porphyrin Based Supramolecular Systems: Theoretical Analysis Versus Experimental Observations (ChemPhysChem 11/2024).

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400526

By:

Osadchuk, Irina;
Luts, Hanna‐Eliisa;
Zahharova, Aleksandra;
Tamm, Toomas;
Borovkov, Victor

Publication type:

Article

Cover Feature: Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy (ChemPhysChem 11/2024).

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400525

By:

Lackinger, Markus

Publication type:

Article

Front Cover: Prediction of Feasibility of Polaronic OER on (110) Surface of Rutile TiO2 (ChemPhysChem 11/2024).

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400060

By:

Pada Sarker, Hori;
Abild‐Pedersen, Frank;
Bajdich, Michal

Publication type:

Article

Prediction of Feasibility of Polaronic OER on the (110) Surface of Rutile TiO2.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400523

By:

Pada Sarker, Hori;
Abild‐Pedersen, Frank;
Bajdich, Michal

Publication type:

Article

Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400156

By:

Lackinger, Markus

Publication type:

Article

Alternating 3rd‐ to 2nd‐Order Charge Reaction Kinetics on Bismuth Vanadate Photoanodes with Ultrathin Bismuth Metal–Organic–Frameworks.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400141

By:

Cao, Guangming;
Liu, Yanjie;
Hu, Jundie;
Qu, Jiafu;
Zhang, Zhichao;
Xiong, Xianqiang;
Sun, Wei;
Yang, Xiaogang;
Li, Chang Ming

Publication type:

Article

Density Functional Theory Calculations on Fluorescence‐Enhanced Mechanisms of the Optical Sensor for Zinc Ions, ADPA.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400140

By:

Su, Quyan;
Li, Yuanming;
Han, Jia;
Zhou, Xiaoguo;
Liu, Shilin

Publication type:

Article

Adiabat‐to‐Diabat Angle in Seam Space: Renner‐Teller‐Type and Pseudo‐Jahn‐Teller‐Type Problems.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400130

By:

Chen, Benny Jun;
Pradhan, Ekadashi;
Nooijen, Marcel;
Zeng, Tao

Publication type:

Article

Controlling Chirogenic Effects in Porphyrin Based Supramolecular Systems: Theoretical Analysis Versus Experimental Observations.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400104

By:

Osadchuk, Irina;
Luts, Hanna‐Eliisa;
Zahharova, Aleksandra;
Tamm, Toomas;
Borovkov, Victor

Publication type:

Article

A Rotational Study of 2‐tert‐Butylphenol and Its 1 : 1 Argon Complex.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400089

By:

Li, Wenqin;
Heras, Domingo;
Maris, Assimo;
Melandri, Sonia;
Lesarri, Alberto;
Evangelisti, Luca

Publication type:

Article

Accurate Experimental Structure of 1‐Chloronaphthalene.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400072

By:

Pinacho, Pablo;
Gómez, Pablo;
López, Juan Carlos;
Blanco, Susana

Publication type:

Article

Multinuclear Residual Quadrupolar Couplings for Structure and Assignment.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400068

By:

John, Michael;
Rüttger, Franziska

Publication type:

Article

Quantum Chemistry and Pharmacy: Diagnostic Check of the Thermochemistry of Ibuprofen.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400066

By:

Emel'yanenko, Vladimir N.;
Zherikova, Kseniya V.;
Verevkin, Sergey P.

Publication type:

Article

Modified Donor End Caps for Binary‐to‐Ternary WORM Memory Conversion in N‐Heteroaromatic Systems.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400062

By:

Gayathri, Ramesh;
Akshaya, Madanan;
Imran, Predhanekar Mohamed;
Nagarajan, Samuthira

Publication type:

Article

Prediction of Feasibility of Polaronic OER on (110) Surface of Rutile TiO2.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400060

By:

Pada Sarker, Hori;
Abild‐Pedersen, Frank;
Bajdich, Michal

Publication type:

Article

Structure‐Guided Evolution of Cyclohexanone Monooxygenase Toward Bulky Omeprazole Sulfide: Substrate Migration and Stereoselectivity Inversion.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202400008

By:

Wei, Shiyu;
Xu, Guochao;
Zhou, Jieyu;
Ni, Ye

Publication type:

Article

Many‐body Effects on Electronic Transport in Molecular Junctions: A Quantum Perspective.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300938

By:

Sarmah, Amrit;
Hobza, Pavel;
Chandra, Asit K.;
Mitra, Sivaprasad;
Nakajima, Takahito

Publication type:

Article

Concentration‐Gradient Structural LiFe0.5Mn0.5PO4/C Prepared via Co‐precipitation Reaction for Advanced Lithium‐Ion Batteries.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300930

By:

Jiang, Xiaoyan;
Li, Lanyan;
Wang, Xianyou;
Luo, Zhigao

Publication type:

Article

Tuning Properties of Layered Materials Based on Hexagonal Boron Nitride by Methylation: A Density Functional Theory Study.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300882

By:

Mazarei, Elham;
Saalfrank, Peter

Publication type:

Article

Phase Diagrams of Anthracene Derivatives in Pyridinium Ionic Liquids.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300867

By:

Watanabe, Satoshi;
Ono, Keigo;
Nakayama, Rinsuke;
Tajiri, Kaho;
Inouchi, Shun;
Matsuo, Takumi;
Kunitake, Masashi;
Hayashi, Shotaro

Publication type:

Article

Attenuating the Polysulfide Shuttle Mechanism by Separator Coating.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300858

By:

Hirt, Sebastian Daniel;
Opitz, Martin;
Kappl, Herbert;
Hägele, Mareike;
Sous, Pascal;
Oberschachtsiek, Bernd;
Sörgel, Seniz;
Kaßner, Holger;
Hoster, Harry Ernst

Publication type:

Article

Sheet Models for Methylaluminoxane (MAO) Activators? A Theoretical Case Study involving rac‐Me2Si(η5‐C9H6)2Zr (SBIZr) Complexes.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300856

By:

Collins, Scott;
Linnolahti, Mikko

Publication type:

Article

Liquid Crystal Dimers and the Twist‐Bend Phases: Non‐Symmetric Dimers Consisting of Mesogenic Units of Differing Lengths.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300848

By:

Gibb, Calum J.;
Majewska, Magdalena;
Pociecha, Damian;
Storey, John M.D.;
Gorecka, Ewa;
Imrie, Corrie T.

Publication type:

Article

Role of Constituent Oxides for Thermal Mineralization of o‐Dichloro Benzene over Mixed‐Oxide‐TiO2 Catalysts: A Mechanistic Explanation.

Published in:

ChemPhysChem, 2024, v. 25, n. 11, p. 1, doi. 10.1002/cphc.202300472

By:

Bhattacharyya, Kaustava;
Kumar, Adarsh;
Tyagi, Deepak;
Tripathi, A. K.;
Tyagi, A. K.

Publication type:

Article

Works matching IS 14394235 AND DT 2024 AND VI 25 AND IP 11

Front Cover: Prediction of Feasibility of Polaronic OER on (110) Surface of Rutile TiO<sub>2</sub> (ChemPhysChem 11/2024)

Cover Feature: Adiabat‐to‐Diabat Angle in Seam Space: Renner‐Teller‐Type and Pseudo‐Jahn‐Teller‐Type Problems (ChemPhysChem 11/2024).

Cover Feature: Controlling Chirogenic Effects in Porphyrin Based Supramolecular Systems: Theoretical Analysis Versus Experimental Observations (ChemPhysChem 11/2024).

Cover Feature: Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy (ChemPhysChem 11/2024).

Front Cover: Prediction of Feasibility of Polaronic OER on (110) Surface of Rutile TiO<sub>2</sub> (ChemPhysChem 11/2024).

Prediction of Feasibility of Polaronic OER on the (110) Surface of Rutile TiO<sub>2</sub>.

Possibilities and Limitations of Kinetic Studies in On‐Surface Synthesis by Real Time X‐ray Photoelectron Spectroscopy.

Alternating 3<sup>rd</sup>‐ to 2<sup>nd</sup>‐Order Charge Reaction Kinetics on Bismuth Vanadate Photoanodes with Ultrathin Bismuth Metal–Organic–Frameworks.

Density Functional Theory Calculations on Fluorescence‐Enhanced Mechanisms of the Optical Sensor for Zinc Ions, ADPA.

Adiabat‐to‐Diabat Angle in Seam Space: Renner‐Teller‐Type and Pseudo‐Jahn‐Teller‐Type Problems.

Controlling Chirogenic Effects in Porphyrin Based Supramolecular Systems: Theoretical Analysis Versus Experimental Observations.

A Rotational Study of 2‐tert‐Butylphenol and Its 1 : 1 Argon Complex.

Accurate Experimental Structure of 1‐Chloronaphthalene.

Multinuclear Residual Quadrupolar Couplings for Structure and Assignment.

Quantum Chemistry and Pharmacy: Diagnostic Check of the Thermochemistry of Ibuprofen.

Modified Donor End Caps for Binary‐to‐Ternary WORM Memory Conversion in N‐Heteroaromatic Systems.

Prediction of Feasibility of Polaronic OER on (110) Surface of Rutile TiO<sub>2</sub>.

Structure‐Guided Evolution of Cyclohexanone Monooxygenase Toward Bulky Omeprazole Sulfide: Substrate Migration and Stereoselectivity Inversion.

Many‐body Effects on Electronic Transport in Molecular Junctions: A Quantum Perspective.

Concentration‐Gradient Structural LiFe<sub>0.5</sub>Mn<sub>0.5</sub>PO<sub>4</sub>/C Prepared via Co‐precipitation Reaction for Advanced Lithium‐Ion Batteries.

Tuning Properties of Layered Materials Based on Hexagonal Boron Nitride by Methylation: A Density Functional Theory Study.

Phase Diagrams of Anthracene Derivatives in Pyridinium Ionic Liquids.

Attenuating the Polysulfide Shuttle Mechanism by Separator Coating.

Sheet Models for Methylaluminoxane (MAO) Activators? A Theoretical Case Study involving rac‐Me<sub>2</sub>Si(η<sup>5</sup>‐C<sub>9</sub>H<sub>6</sub>)<sub>2</sub>Zr (SBIZr) Complexes.

Liquid Crystal Dimers and the Twist‐Bend Phases: Non‐Symmetric Dimers Consisting of Mesogenic Units of Differing Lengths.

Role of Constituent Oxides for Thermal Mineralization of o‐Dichloro Benzene over Mixed‐Oxide‐TiO<sub>2</sub> Catalysts: A Mechanistic Explanation.