Mechanical properties of graphene, defective graphene, multilayer graphene and SiC-graphene composites: A molecular dynamics study

2021 ◽  
pp. 413250
Author(s):  
Yugesh Kumar ◽  
Sukadev Sahoo ◽  
Amit K. Chakraborty
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Multilayer Graphene ◽  
Defective Graphene

scholarly journals Molecular dynamics simulation of the mechanical properties of multilayer graphene oxide nanosheets

RSC Advances ◽  
2017 ◽  
Vol 7 (87) ◽  
pp. 55005-55011 ◽  
Author(s):  
Xu Zhang ◽  
Shuyan Liu ◽  
Han Liu ◽  
Jinwen Zhang ◽  
Xiaoning Yang
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Graphene Oxide ◽  
Molecular Dynamics Simulation ◽  
Failure Mechanism ◽  
Md Simulation ◽  
Dynamics Simulation ◽  
Multilayer Graphene ◽  
Graphene Oxide Nanosheets ◽  
Non Equilibrium

The mechanical properties and failure mechanism of multilayer GO nanosheets were studied by non-equilibrium MD simulation.

scholarly journals Correction: Molecular dynamics simulation of the mechanical properties of multilayer graphene oxide nanosheets

RSC Advances ◽  
2018 ◽  
Vol 8 (40) ◽  
pp. 22785-22785 ◽  
Author(s):  
Xu Zhang ◽  
Shuyan Liu ◽  
Hang Liu ◽  
Jinwen Zhang ◽  
Xiaoning Yang
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Graphene Oxide ◽  
Molecular Dynamics Simulation ◽  
Dynamics Simulation ◽  
Multilayer Graphene ◽  
Graphene Oxide Nanosheets

Correction for ‘Molecular dynamics simulation of the mechanical properties of multilayer graphene oxide nanosheets’ by Xu Zhang et al., RSC Adv., 2017, 7, 55005–55011.

scholarly journals A reactive molecular dynamics study on the mechanical properties of a recently synthesized amorphous carbon monolayer converted into a nanotube/nanoscroll

2021 ◽  
Author(s):  
Marcelo Lopes Pereira Junior ◽  
Wiliam Ferreira da Cunha ◽  
Douglas Soares Galvão ◽  
Luiz Antonio Ribeiro Junior
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Chemical Vapor Deposition ◽  
Amorphous Carbon ◽  
Vapor Deposition ◽  
Chemical Vapor ◽  
Free Standing ◽  
Reactive Molecular Dynamics

Recently, laser-assisted chemical vapor deposition has been used to synthesize a free-standing, continuous, and stable monolayer amorphous carbon (MAC).

Molecular Dynamics Simulation of Crack Initiation of Aluminum under Tensile Deformation

2011 ◽  
Vol 378-379 ◽  
pp. 7-10
Author(s):  
Gui Xue Bian ◽  
Yue Liang Chen ◽  
Jian Jun Hu ◽  
Li Xu
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Elastic Constants ◽  
Tensile Deformation ◽  
Crack Nucleation ◽  
Tensile Load ◽  
Dynamics Simulation ◽  
Metal Aluminum ◽  
Impurity Metal

Molecular dynamics simulation was used to simulate the tension process of purity and containing impurity metal aluminum. Elastic constants of purity and containing impurity metal aluminum were calculated, and the effects of impurity on the elastic constants were also studied. The results show that O-Al bond and Al-Al bond near oxygen atoms could be the sites of crack nucleation or growth under tensile load, the method can be extended to research mechanical properties of other metals and alloys structures.

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