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...
Main Authors: | , , |
---|---|
Format: | Article |
Language: | English |
Published: |
MDPI AG
2023-02-01
|
Series: | Forests |
Subjects: | |
Online Access: | https://www.mdpi.com/1999-4907/14/2/371 |