Works matching IS 14394235 AND DT 2022 AND VI 23 AND IP 6

Results: 13

Front Cover: Elucidating 2D Charge‐Density‐Wave Atomic Structure in an MX–Chain by the 3D‐ΔPair Distribution Function Method (ChemPhysChem 6/2022).

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202200121

By:

Guérin, Laurent;
Yoshida, Takefumi;
Zatterin, Edoardo;
Simonov, Arkadiy;
Chernyshov, Dmitry;
Iguchi, Hiroaki;
Toudic, Bertrand;
Takaishi, Shinya;
Yamashita, Masahiro

Publication type:

Article

Bond Length Alternation and Internal Dynamics in Model Aromatic Substituents of Lignin.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100808

By:

Hernandez‐Castillo, A. O.;
Calabrese, Camilla;
Fritz, Sean M.;
Uriarte, Iciar;
Cocinero, Emilio J.;
Zwier, Timothy S.

Publication type:

Article

A First‐Principles Study of CO2 Hydrogenation on a Niobium‐Terminated NbC (111) Surface.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100781

By:

Sarabadani Tafreshi, Saeedeh;
Ranjbar, Mahkameh;
Taghizade, Narges;
Panahi, S. F. K. S.;
Jamaati, Maryam;
de Leeuw, Nora H.

Publication type:

Article

Cover Feature: Influence of Substituents in the Benzene Ring on the Halogen Bond of Iodobenzene with Ammonia (ChemPhysChem 6/2022).

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202200122

By:

Scheiner, Steve;
Hunter, Sarah

Publication type:

Article

Elucidating 2D Charge‐Density‐Wave Atomic Structure in an MX–Chain by the 3D‐ΔPair Distribution Function Method.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202200120

By:

Guérin, Laurent;
Yoshida, Takefumi;
Zatterin, Edoardo;
Simonov, Arkadiy;
Chernyshov, Dmitry;
Iguchi, Hiroaki;
Toudic, Bertrand;
Takaishi, Shinya;
Yamashita, Masahiro

Publication type:

Article

Simulations to Cover the Waterfront for Iron Oxide Catalysis.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202200025

By:

Snir, Nadav;
Caspary Toroker, Maytal

Publication type:

Article

Influence of Substituents in the Benzene Ring on the Halogen Bond of Iodobenzene with Ammonia.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202200011

By:

Scheiner, Steve;
Hunter, Sarah

Publication type:

Article

Introducing a New d0 Sc3+ Asymmetric Ion for Functional Materials: Large Birefringence Enhancement by ScO6 in Ba3Sc2(BO3)4.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202200002

By:

Zhou, Jingfang;
Li, Rukang

Publication type:

Article

Rare Tautomers of Artificially Expanded Genetic Letters and their Effects on the Base Pair Stabilities.

Published in:: ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100908
Publication type:: Article

Periodicity of Two‐Dimensional Bonding of Main Group Elements.

Published in:: ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100880
Publication type:: Article

Elucidating 2D Charge‐Density‐Wave Atomic Structure in an MX–Chain by the 3D‐ΔPair Distribution Function Method**.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100857

By:

Guérin, Laurent;
Yoshida, Takefumi;
Zatterin, Edoardo;
Simonov, Arkadiy;
Chernyshov, Dmitry;
Iguchi, Hiroaki;
Toudic, Bertrand;
Takaishi, Shinya;
Yamashita, Masahiro

Publication type:

Article

Temperature‐Dependent Terahertz Spectra of Isonicotinamide in the Form I Studied Using the Quasi‐Harmonic Approximation.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100849

By:

Li, Yin;
Sun, Yiwen;
Li, Qiqi;
Lei, Jiangtao;
Yang, Bo;
Shen, Yun;
Cai, Yingxiang;
Deng, Xiaohua

Publication type:

Article

Charge Carrier Transport Mechanism in Ta2O5, TaON, and Ta3N5 Studied by Applying Polaron Hopping and Bandlike Models.

Published in:

ChemPhysChem, 2022, v. 23, n. 6, p. 1, doi. 10.1002/cphc.202100859

By:

Zhao, Qianyu;
Cui, Mengsi;
Liu, Taifeng

Publication type:

Article

Works matching IS 14394235 AND DT 2022 AND VI 23 AND IP 6

Front Cover: Elucidating 2D Charge‐Density‐Wave Atomic Structure in an MX–Chain by the 3D‐ΔPair Distribution Function Method (ChemPhysChem 6/2022).

Bond Length Alternation and Internal Dynamics in Model Aromatic Substituents of Lignin.

A First‐Principles Study of CO<sub>2</sub> Hydrogenation on a Niobium‐Terminated NbC (111) Surface.

Cover Feature: Influence of Substituents in the Benzene Ring on the Halogen Bond of Iodobenzene with Ammonia (ChemPhysChem 6/2022).

Elucidating 2D Charge‐Density‐Wave Atomic Structure in an MX–Chain by the 3D‐ΔPair Distribution Function Method.

Simulations to Cover the Waterfront for Iron Oxide Catalysis.

Influence of Substituents in the Benzene Ring on the Halogen Bond of Iodobenzene with Ammonia.

Introducing a New d<sup>0</sup> Sc<sup>3+</sup> Asymmetric Ion for Functional Materials: Large Birefringence Enhancement by ScO<sub>6</sub> in Ba<sub>3</sub>Sc<sub>2</sub>(BO<sub>3</sub>)<sub>4</sub>.

Rare Tautomers of Artificially Expanded Genetic Letters and their Effects on the Base Pair Stabilities.

Periodicity of Two‐Dimensional Bonding of Main Group Elements.

Elucidating 2D Charge‐Density‐Wave Atomic Structure in an MX–Chain by the 3D‐ΔPair Distribution Function Method**.

Temperature‐Dependent Terahertz Spectra of Isonicotinamide in the Form I Studied Using the Quasi‐Harmonic Approximation.

Charge Carrier Transport Mechanism in Ta<sub>2</sub>O<sub>5</sub>, TaON, and Ta<sub>3</sub>N<sub>5</sub> Studied by Applying Polaron Hopping and Bandlike Models.