Molecular Dynamics Study on Mechanical Properties of Cellulose with Water Molecules Diffusion Behavior at Different Oxygen Concentrations

Six groups of cellulose-water-oxygen simulation models with oxygen concentrations of 0%, 2%, 4%, 6%, 8%, and 10% were established by molecular dynamics software to analyze the effect of oxygen concentration on the mechanical properties of wood cellulose during water vapor heat treatment in terms of...

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Bibliographic Details
Main Authors: Yuanyuan Guo, Wei Wang, Xuewei Jiang
Format: Article
Language:English
Published: MDPI AG 2023-02-01
Series:Forests
Subjects:
Online Access:https://www.mdpi.com/1999-4907/14/2/371