scholarly journals Revealing the deformation mechanism of amorphous polyethylene subjected to cycle loading via molecular dynamics simulations

RSC Advances ◽  
2018 ◽  
Vol 8 (56) ◽  
pp. 32377-32386 ◽  
Author(s):  
Qihong Fang ◽  
Yuanyuan Tian ◽  
Hong Wu ◽  
Jia Li
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Deformation Mechanism ◽  
Deformation Behavior ◽  
Shear Loading ◽  
Cycle Loading ◽  
Dynamics Simulations

Despite tremendous efforts being devoted to the study of the deformation behavior of polyethylene, the deformation mechanism of an amorphous polyethylene polymer under cycle shear-loading remains largely unknown.

scholarly journals Deformation mechanism in Al0.1CoCrFeNi Σ3(111)[11̄0] high entropy alloys – molecular dynamics simulations

RSC Advances ◽  
2020 ◽  
Vol 10 (46) ◽  
pp. 27688-27696
Author(s):  
Cuixia Liu ◽  
Yuchia Yang ◽  
Zhenhai Xia
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Grain Boundaries ◽  
Deformation Mechanism ◽  
Deformation Behavior ◽  
Compressive Loading ◽  
High Entropy Alloys ◽  
High Entropy ◽  
Dynamics Simulations

Build grain boundaries for Al0.1CoCrFeNi Σ3(111)[11̄0] HEA and elucidate the deformation behavior under tensile and compressive loading.

Effect of water film on the plastic deformation of monocrystalline copper

RSC Advances ◽  
2016 ◽  
Vol 6 (99) ◽  
pp. 96824-96831 ◽  
Author(s):  
Junqin Shi ◽  
Yanan Zhang ◽  
Kun Sun ◽  
Liang Fang
Keyword(s):  
Molecular Dynamics ◽  
Plastic Deformation ◽  
Molecular Dynamics Simulations ◽  
Deformation Behavior ◽  
Water Film ◽  
Effect Of Water ◽  
Plastic Deformation Behavior ◽  
Dynamics Simulations

The effect of a water film on the plastic deformation behavior and mechanism of monocrystalline copper are studied by molecular dynamics simulations.

scholarly journals Deformation behavior of annealed Cu64Zr36 metallic glass via molecular dynamics simulations

2020 ◽  
Vol 191 ◽  
pp. 108660 ◽  
Author(s):  
Xingxing Yue ◽  
Jamieson Brechtl ◽  
Fajie Wang ◽  
Zexin Chang ◽  
Peter K. Liaw ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Metallic Glass ◽  
Molecular Dynamics Simulations ◽  
Deformation Behavior ◽  
Dynamics Simulations

In Situ Spectroscopy and Modeling of Deformation Behavior of Nanoscale Interfacial Materials

2011 ◽  
Vol 1297 ◽  
Author(s):  
Takakazu Suzuki ◽  
W. Suetaka ◽  
A. Suzuki ◽  
T. Sato ◽  
T. Suzuki
Keyword(s):  
Thin Film ◽  
Thin Films ◽  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Deformation Behavior ◽  
Molecular Orientation ◽  
In Situ Spectroscopy ◽  
Dynamics Simulations ◽  
Interfacial Films

ABSTRACTIn this work, the behavior of molecules in thin-film lubricants, several tens of nanometers thick, is studied by in situ reflection infrared spectroscopy and by molecular dynamics simulations. The effect of fatty acid additives on the properties of these interfacial films is also studied. The results of these experiments are presented and interpreted, and the latest outcomes of molecular dynamics simulations are discussed. It is concluded that the molecular orientation in thin films of interfacial materials is markedly affected by the use of additives.

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