Machine Learning-Assisted High-Throughput Molecular Dynamics Simulation of High-Mechanical Performance Carbon Nanotube Structure

Machine Learning-Assisted High-Throughput Molecular Dynamics Simulation of High-Mechanical Performance Carbon Nanotube Structure

Carbon nanotubes (CNTs) are novel materials with extraordinary mechanical properties. To gain insight on the design of high-mechanical-performance CNT-reinforced composites, the optimal structure of CNTs with high nominal tensile strength was determined in this study, where the nominal values corres...

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Bibliographic Details
Main Authors: Yi Xiang, Koji Shimoyama, Keiichi Shirasu, Go Yamamoto
Format: Article
Language:English
Published: MDPI AG 2020-12-01
Series:Nanomaterials
Subjects:
carbon nanotube
molecular dynamics simulations
mechanical properties
Frenkel-pair crosslink
machine learning
Online Access:https://www.mdpi.com/2079-4991/10/12/2459

Internet

https://www.mdpi.com/2079-4991/10/12/2459

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