Fully Atomistic Molecular Dynamics Computation of Physico-Mechanical Properties of PB, PS, and SBS

Fully Atomistic Molecular Dynamics Computation of Physico-Mechanical Properties of PB, PS, and SBS

The physical properties&#8212;including density, glass transition temperature (<i>T</i><sub>g</sub>), and tensile properties&#8212;of polybutadiene (PB), polystyrene (PS) and poly (styrene-butadiene-styrene: SBS) block copolymer were predicted by using atomistic molec...

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Bibliographic Details
Main Authors: Yang Kang, Dunhong Zhou, Qiang Wu, Fuyan Duan, Rufang Yao, Kun Cai
Format: Article
Language:English
Published: MDPI AG 2019-07-01
Series:Nanomaterials
Subjects:
molecular dynamics
glass transition
uniaxial tensile
linearized Eyring-like model
Young’s modulus
Online Access:https://www.mdpi.com/2079-4991/9/8/1088

Internet

https://www.mdpi.com/2079-4991/9/8/1088

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