Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation

This paper investigated the micromechanical behavior of different 6H-SiC/Al systems during the uniaxial tensile loading by using molecular dynamics simulations. The results showed that the interface models responded diversely to the tensile stress when the four low-index surfaces of the Al were used...

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Main Authors: Kai Feng, Jiefang Wang, Shiming Hao, Jingpei Xie
Format: Article
Language:English
Published: MDPI AG 2023-01-01
Series:Nanomaterials
Subjects:
Online Access:https://www.mdpi.com/2079-4991/13/3/404
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author Kai Feng
Jiefang Wang
Shiming Hao
Jingpei Xie
author_facet Kai Feng
Jiefang Wang
Shiming Hao
Jingpei Xie
author_sort Kai Feng
collection DOAJ
description This paper investigated the micromechanical behavior of different 6H-SiC/Al systems during the uniaxial tensile loading by using molecular dynamics simulations. The results showed that the interface models responded diversely to the tensile stress when the four low-index surfaces of the Al were used as the variables of the joint surfaces. In terms of their stress–strain properties, the SiC(0001)/Al(001) models exhibited the highest tensile strength and the smallest elongation, while the other models produced certain deformations to relieve the excessive strain, thus increasing the elongation. The SiC(0001)/Al(110) models exhibited the largest elongations among all the models. From the aspect of their deformation characteristics, the SiC(0001)/Al(001) model performed almost no plastic deformation and dislocations during the tensile process. The deformation of the SiC(0001)/Al(110) model was dominated by the slip of the 1/6 <112> Shockley partial dislocations, which contributed to the intersecting stacking faults in the model. The SiC(0001)/Al(111) model produced a large number of dislocations under the tensile loading. Dislocation entanglement was also found in the model. Meanwhile, a unique defect structure consisting of three 1/6 <110> stair-rod dislocations and three stacking faults were found in the model. The plastic deformation in the SiC(0001)/Al(112) interface model was restricted by the L-C lock and was carried out along the 1/6 <110> stair-rod dislocations’ direction. These results reveal the interfacial micromechanical behaviors of the 6H-SiC/Al composites and demonstrate the complexity of the deformation systems of the interfaces under stress.
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spelling doaj.art-9a8048d3c5e345cab2367e39ad99a57e2023-11-16T17:34:12ZengMDPI AGNanomaterials2079-49912023-01-0113340410.3390/nano13030404Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile DeformationKai Feng0Jiefang Wang1Shiming Hao2Jingpei Xie3School of Physics and Microelectronics, Zhengzhou University, Zhengzhou 450052, ChinaSchool of Physics and Microelectronics, Zhengzhou University, Zhengzhou 450052, ChinaSchool of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, ChinaSchool of Materials Science and Engineering, Henan University of Science and Technology, Luoyang 471023, ChinaThis paper investigated the micromechanical behavior of different 6H-SiC/Al systems during the uniaxial tensile loading by using molecular dynamics simulations. The results showed that the interface models responded diversely to the tensile stress when the four low-index surfaces of the Al were used as the variables of the joint surfaces. In terms of their stress–strain properties, the SiC(0001)/Al(001) models exhibited the highest tensile strength and the smallest elongation, while the other models produced certain deformations to relieve the excessive strain, thus increasing the elongation. The SiC(0001)/Al(110) models exhibited the largest elongations among all the models. From the aspect of their deformation characteristics, the SiC(0001)/Al(001) model performed almost no plastic deformation and dislocations during the tensile process. The deformation of the SiC(0001)/Al(110) model was dominated by the slip of the 1/6 <112> Shockley partial dislocations, which contributed to the intersecting stacking faults in the model. The SiC(0001)/Al(111) model produced a large number of dislocations under the tensile loading. Dislocation entanglement was also found in the model. Meanwhile, a unique defect structure consisting of three 1/6 <110> stair-rod dislocations and three stacking faults were found in the model. The plastic deformation in the SiC(0001)/Al(112) interface model was restricted by the L-C lock and was carried out along the 1/6 <110> stair-rod dislocations’ direction. These results reveal the interfacial micromechanical behaviors of the 6H-SiC/Al composites and demonstrate the complexity of the deformation systems of the interfaces under stress.https://www.mdpi.com/2079-4991/13/3/404molecular dynamicsinterfacetensiledislocation movementdeformation mechanism
spellingShingle Kai Feng
Jiefang Wang
Shiming Hao
Jingpei Xie
Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation
Nanomaterials
molecular dynamics
interface
tensile
dislocation movement
deformation mechanism
title Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation
title_full Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation
title_fullStr Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation
title_full_unstemmed Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation
title_short Molecular Dynamics Study of Interfacial Micromechanical Behaviors of 6H-SiC/Al Composites under Uniaxial Tensile Deformation
title_sort molecular dynamics study of interfacial micromechanical behaviors of 6h sic al composites under uniaxial tensile deformation
topic molecular dynamics
interface
tensile
dislocation movement
deformation mechanism
url https://www.mdpi.com/2079-4991/13/3/404
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AT jiefangwang moleculardynamicsstudyofinterfacialmicromechanicalbehaviorsof6hsicalcompositesunderuniaxialtensiledeformation
AT shiminghao moleculardynamicsstudyofinterfacialmicromechanicalbehaviorsof6hsicalcompositesunderuniaxialtensiledeformation
AT jingpeixie moleculardynamicsstudyofinterfacialmicromechanicalbehaviorsof6hsicalcompositesunderuniaxialtensiledeformation