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Works matching IS 00207608 AND DT 2024 AND VI 124 AND IP 8

Results: 6

1

The g‐ZnO/Hf<sub>2</sub>CO<sub>2</sub> vdW heterostructure: A novel two‐dimensional material for sunlight‐driven photocatalytic water splitting.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 8, p. 1, doi. 10.1002/qua.27377

By:

Miao, Feng;
Zhao, Jianling;
Li, Huiran;
Li, Junyu;
Feng, Shiquan

Publication type:

Article

2

Theoretical designs of ORR/OER single‐atom catalysts TM@Ti<sub>2</sub>CT<sub>2</sub> (T = O, S, Cl).

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 8, p. 1, doi. 10.1002/qua.27374

By:

Shen, Pengcheng;
Li, Jice;
Zhang, Zhizhao;
Liu, Hui;
Liang, LiMin;
Chen, Cong;
Li, Ying

Publication type:

Article

3

Extended improved multiparameter exponential‐type potential energy function for diatomic molecules.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 8, p. 1, doi. 10.1002/qua.27373

By:

Kang, Deyu;
Fan, Qunchao;
Fan, Zhixiang;
Li, Huidong;
Fu, Jia

Publication type:

Article

4

A DFT calculation of electronic structures, magnetic, and thermoelectric properties of the new equiatomic quaternary Heusler alloy RuTiCrSi.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 8, p. 1, doi. 10.1002/qua.27371

By:

Dergal, Samiha;
Al‐Qaisi, Samah;
Rached, Habib;
Ouerdane, Abdellah

Publication type:

Article

5

DFT study of the half‐metallic variant perovskites A<sub>2</sub>OsX<sub>6</sub> (A = Rb/Cs; X = Cl/Br) for spintronic and thermoelectric applications.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 8, p. 1, doi. 10.1002/qua.27370

By:

Ullah, Rehan;
Faizan, Muhammad;
Khan, Shah Haidar

Publication type:

Article

6

Issue Information.

Published in:: International Journal of Quantum Chemistry, 2024, v. 124, n. 8, p. 1, doi. 10.1002/qua.27157
Publication type:: Article