Atomic Scale Simulation on the Fracture Mechanism of Black Phosphorus Monolayer under Indentation

Atomic Scale Simulation on the Fracture Mechanism of Black Phosphorus Monolayer under Indentation

Molecular dynamics simulations on the indentation process of freestanding and Pt(111)-supported black phosphorus (BP) monolayer were conducted to study the fracture mechanism of the membrane. For the freestanding BP monolayer, crack grows firstly along armchair direction and then zigzag direction du...

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Bibliographic Details
Main Authors: Yang Liu, Yuhong Liu, Jianbin Luo
Format: Article
Language:English
Published: MDPI AG 2018-09-01
Series:Nanomaterials
Subjects:
molecular dynamics simulation
black phosphorus
indentation
deformation
rupture
Online Access:http://www.mdpi.com/2079-4991/8/9/682

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