武汉理工大学学报(交通科学与工程版)2024,Vol.48Issue(2) :353-358.DOI:10.3963/j.issn.2095-3844.2024.02.026

基于分子动力学的聚氨酯改性沥青自愈合行为研究

Study on Self-healing Behavior of Polyurethane Modified Bitumen Based on Molecular Dynamics

夏广林 刘云
武汉理工大学学报(交通科学与工程版)2024,Vol.48Issue(2) :353-358.DOI:10.3963/j.issn.2095-3844.2024.02.026

基于分子动力学的聚氨酯改性沥青自愈合行为研究

Study on Self-healing Behavior of Polyurethane Modified Bitumen Based on Molecular Dynamics

夏广林 1刘云1
扫码查看

作者信息

  • 1. 河海大学道路与铁道工程研究所 南京 210098
  • 折叠

摘要

文中采用分子动力学方法建立了基质沥青和PU改性沥青自愈合模型.通过密度、能量、温度,以及Z轴浓度曲线研究了 PU改性沥青的自愈合行为.通过扩散系数、自由体积分数和氢键分析了 PU对沥青自愈合的影响.结果表明:PU改性沥青的自愈合行为分为:能量获取、流动扩散、自愈合,以及分子平衡四个阶段.当温度相同时,PU对沥青的自愈合有促进作用.PU与沥青分子间氢键的形成,使愈合结束的模型强度更高.

Abstract

The self-healing model of matrix asphalt and PU modified asphalt was established by molecu-lar dynamics method.The self-healing behavior of PU modified asphalt was studied by density,ener-gy,temperature and Z-axis concentration curves.The influence of PU on asphalt self-healing was ana-lyzed by diffusion coefficient,free volume fraction and hydrogen bond.The results show that the self-healing behavior of PU modified asphalt can be divided into four stages:energy acquisition,flow dif-fusion,self-healing and molecular balance.When the temperature is the same,PU can promote the self-healing of asphalt.Meanwhile,the formation of hydrogen bonds between PU and asphalt mole-cules makes the model with the end of healing stronger.

关键词

自愈合/聚氨酯改性沥青/分子动力学/扩散能力/数值模拟

Key words

self-healing/polyurethane modified asphalt/molecular dynamics/diffusion ability/numer-ical simulation

引用本文复制引用

出版年

2024
武汉理工大学学报(交通科学与工程版)
武汉理工大学

武汉理工大学学报(交通科学与工程版)

CSTPCD
影响因子:0.462
ISSN:2095-3844
参考文献量4
段落导航相关论文