Phase Transition of Single-Layer Molybdenum Disulfide Nanosheets under Mechanical Loading Based on Molecular Dynamics Simulations

Phase Transition of Single-Layer Molybdenum Disulfide Nanosheets under Mechanical Loading Based on Molecular Dynamics Simulations

The single-layer molybdenum disulfide (SLMoS2) nanosheets have been experimentally discovered to exist in two different polymorphs, which exhibit different electrical properties, metallic or semiconducting. Herein, molecular dynamics (MD) simulations of nanoindentation and uniaxial compression were...

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Bibliographic Details
Main Authors: Haosheng Pang, Minglin Li, Chenghui Gao, Haili Huang, Weirong Zhuo, Jianyue Hu, Yaling Wan, Jing Luo, Weidong Wang
Format: Article
Language:English
Published: MDPI AG 2018-03-01
Series:Materials
Subjects:
MoS2
phase transition
molecular dynamics
nanoindentation
uniaxial compression
Online Access:http://www.mdpi.com/1996-1944/11/4/502

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