Small stoichiometric (MoS2)n clusters with the 1T phase-Reference-Cited by-同舟云学术

Small stoichiometric (MoS2)n clusters with the 1T phase

Published:2018 Issue:9 Volume:20 Page:6365-6373
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Wang Ya-Ya¹²³⁴,Deng Jia-Jun¹²³⁴,Wang Xin¹²³⁴,Che Jian-Tao¹²³⁴,Ding Xun-Lei¹²³⁴^ORCID

Affiliation:

1. Department of Mathematics and Physics

2. North China Electric Power University

3. Beijing

4. P. R. China

Abstract

Stoichiometric (MoS₂)_n clusters (n = 1–6) were systematically studied by density functional theory calculations with hybrid B3LYP and pure GGA PW91 functionals.

Funder

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C7CP07914A

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