【作者单位】1 School of Transportation, Southeast University, Nanjing, Jiangsu 211189, China 2 National Demonstration Center for Experimental Road and Traffic Engineering Education (Southeast University), Nanjing, Jiangsu 211189, China 3 College of Engineering, Tibet University, Lhasa, Tibet 850000, China 4 School of Highway, Chang'an University, Xi'an, Shaanxi 710064, China 5 Department of Civil and Environmental Engineering, School of Engineering, Rutgers, The State University of New Jersey, New Brunswick, USA
【摘要】 Aging behaviors of asphaltene are elaborated by AIMD simulation and static DFT study. • Asphaltene loses H and tends to isomerize and adsorb O 2 to reduce energy during aging. • Polarity and binding energy of asphaltenes rise after aging, leading to ...