基于分子动力学两集料间沥青的拉伸黏附机理  

Tensile Adhesion Mechanism of Asphalt Confined in Two Aggregates Based on Molecular Dynamics

作　　者：潘伶[1] 张晋铭[1] 吕志田 林旭健[2] PAN Ling;ZHANG Jinming;LÜZhitian;LIU Xujian(School of Mechanical Engineering and Automation,Fuzhou University,Fuzhou 350108,China;School of Civil Engineering,Fuzhou University,Fuzhou 350108,China)

机构地区：[1]福州大学机械工程及自动化学院,福建福州350108 [2]福州大学土木工程学院,福建福州350108

出　　处：《建筑材料学报》2021年第5期1054-1059,1122,共7页Journal of Building Materials

基　　金：国家自然科学基金资助项目(51875105,51708120);晋江市福大科教园区发展中心科研项目(2019-JJFDKY-54);福建省交通运输科技项目(201509)。

摘　　要：基于分子动力学(MD)模拟,建立了两集料间沥青的模型,研究了拉伸速率、温度对沥青-集料界面拉伸应力-位移曲线的影响,从原子尺度分析了沥青-集料界面的拉伸破坏形式和黏附机理,同时通过拟合拉伸应力-位移曲线,提出了适用于宏观数值分析的内聚力模型.结果表明:当拉伸应力超过应力峰值后,沥青-集料的破坏由以黏附破坏为主转变为以黏聚破坏为主;拉伸速率越大,应力峰值越大;温度越高,应力峰值越小;沥青在拉伸应力达到应力峰值之前保持弹性状态,此时变形可逆,当拉伸应力超过应力峰值后,受到的损伤不可逆.Based on molecular dynamics(MD)simulation,a model of asphalt confined in two aggregates was constructed,and the effects of tensile rate and temperature on the tensile stress-displacement curve of asphalt-aggregate interface were studied.The tensile failure mode and adhesion mechanism of asphalt-aggregate interface were analyzed in atomic nanoscale.By fitting the tensile stress-displacement curves,the cohesive model for macro numerical analysis was proposed.The results show that the failure of asphalt-aggregate changes from adhesive failure to cohesive failure when the tensile stress exceeds the peak stress.The peak stress increases with the tensile velocity and decreases with the temperature.Before the tensile stress reaches the peak stress,the asphalt remains in an elastic state,and the deformation is reversible.When the tensile stress exceeds the peak stress,the damage is irreversible.

关 键 词：沥青-集料界面 拉伸作用 黏附机理 内聚力模型 分子动力学模拟 

分 类 号：U416.217[交通运输工程—道路与铁道工程]