Adhesion between asphalt molecules and acid aggregates under extreme temperature: A ReaxFF reactive molecular dynamics study
Zengguang Xu, Yixuan Wang, Jing Cao, Junrui Chai, Cheng Cao, Zheng Si, Yanlong Li
Topics & Concepts
ReaxFFvan der Waals forceAsphaltMolecular dynamicsMoleculeMaterials scienceAdhesionHydrogen bondAsphalteneIntermolecular forceChemical physicsComposite materialChemistryComputational chemistryOrganic chemistryAsphalt Pavement Performance EvaluationPetroleum Processing and AnalysisSurfactants and Colloidal Systems