Self-healing Mechanism of Asphalt: Molecular Modeling and Shear-healing Test

Yefei Wang , Hongyu Chen , Yan Yuan , Song Xu , Hewei Jiang

Journal of Wuhan University of Technology Materials Science Edition ›› 2025, Vol. 40 ›› Issue (5) : 1372 -1378.

PDF
Journal of Wuhan University of Technology Materials Science Edition ›› 2025, Vol. 40 ›› Issue (5) :1372 -1378. DOI: 10.1007/s11595-025-3174-9
Cementitious Materials
research-article

Self-healing Mechanism of Asphalt: Molecular Modeling and Shear-healing Test

Author information +
History +
PDF

Abstract

This study aims to investigate the intrinsic repair behavior of asphalt using molecular dynamics simulation. The Materials Studio software was employed to construct a virgin asphalt and SBS modified asphalt. The evaluation of the two types of asphalt included diffusion coefficient, activation energy of diffusion, and pre-exponential factor. The self-healing performance of both virgin asphalt and SBS modified asphalt was then analyzed and verified through fatigue shear-healing tests. The molecular dynamics results indicate that the self-healing properties of both asphalts improve with increasing temperature. The time required for the cracked area to be filled was found to be shorter than the time needed for the asphalt material to recover its mechanical properties. Furthermore, the activation energy of diffusion for SBS modified asphalt was slightly higher compared to that of virgin asphalt, as observed in the experimental results. The self-healing speed and collision frequency of SBS modified asphalt were both faster than those of virgin asphalt, indicating that the self-healing performance of SBS modified asphalt is superior overall.

Keywords

asphalt binder / molecular dynamics / self-healing / diffusion coefficient

Cite this article

Download citation ▾
Yefei Wang, Hongyu Chen, Yan Yuan, Song Xu, Hewei Jiang. Self-healing Mechanism of Asphalt: Molecular Modeling and Shear-healing Test. Journal of Wuhan University of Technology Materials Science Edition, 2025, 40(5): 1372-1378 DOI:10.1007/s11595-025-3174-9

登录浏览全文

4963

注册一个新账户 忘记密码

References

[1]

Zhu J Y. Molecular Dynamics Simulation of Self-healing Behavior of Asphalt Binder[J]. Journal of Construction Materials, 2018, 21(3): 433-439

[2]

Yang J, Gong M H, Wang X T, et al.. Observation and Characterization of Asphalt Microstructure by Atomic Force Microscopy[J]. Journal of Southeast University (English Edition), 2014, 30: 353-357

[3]

Ding Y, Huang B, Xiang S, et al.. Woods, Use of Molecular Dynamics to Investigate Diffusion between Virgin and Aged Asphalt Binders[J]. Fuel, 2016, 174: 267-273

[4]

Zhang H T, Zhang Q H, Li M, et al.. Behavior Characteristics of Asphalt Components during the Process of Nano-cracks Temperature Self-healing[J]. Journal of Wuhan University of Technology-Mater. Sci. Ed., 2023, 38(1): 149-155

[5]

Yang J, Wang H P, Liao H. Key Influential Factors of Fatigue and Self-healing Properties of Asphalt Mixture[J]. Journal of Southeast University (Natural Science Edition), 2016, 46(1): 196-201

[6]

Zhou L, Huang W D, Lu Q. Evaluation and Mechanism Analysis of Self-healing Performance of Asphalt under Dry and Wet Conditions[J]. Journal of Construction Materials, 2021, 24(1): 137-145

[7]

Sun D, Sun G, Zhu X, et al.. Identification of Wetting and Molecular Diffusion Stages During Self-Healing Process of Asphalt Binder via Fluorescence Microscope[J]. Construction and Building Materials, 2017, 132(1): 230-239

[8]

Xu G, Wang H. Study of Cohesion and Adhesion Properties of Asphalt Concrete with Molecular Dynamics Simulation[J]. Computational Materials Science, 2016, 112: 161-169

[9]

Xu G, Wang H. Molecular Dynamics Study of Interfacial Mechanical Behavior between Asphalt Binder and Mineral Aggregate[J]. Construction and Building Materials, 2016, 121: 246-254

[10]

Xu G, Wang H, Sun W. Molecular Dynamics Study of Rejuvenator Effect on RAP Binder: Diffusion Behavior and Molecular Structure[J]. Construction and Building Materials, 2018, 158: 1 046-1 054

[11]

Sun W, Wang H. Moisture Effect on Nanostructure and Adhesion Energy of Asphalt on Aggregate Surface: A Molecular Dynamics Study[J]. Applied Surface Science, 2020, 510: 145 435

[12]

Little D N, Lytton R L, Williams D, et al.. An Analysis of the Mechanism of Microdamage Healing Based on the Application of Micromechanics First Principles of Fracture and Healing[J]. Journal of The Association of Asphalt Paving Technologists, 1999, 68: 501-504

[13]

Wool R P, O’Connor K. A Theory Crack Healing in Polymers[J]. Journal of Applied Physics, 1981, 52(10): 5 953-5 963

[14]

Qiu J, M. Ven M V D, Wu S, et al.. Self-healing Characteristics of Bituminous Mastics Using A Modified Direct Tension Test[J]. Journal of Intelligent Material Systems and Structures, 2012, 25(1): 58-66

[15]

Sun D, Lin T, Zhu X, et al.. Indices for Self-healing Performance Assessments Based on Molecular Dynamics Simulation of Asphalt Binders[J]. Computational Materials Science, 2016, 144: 86-93

[16]

Li D, Greenfield M L. Chemical Compositions of Improved Model Asphalt Systems for Molecular Simulations[J]. Fuel, 2014, 115: 347-356

[17]

Lesueur D. The Colloidal Structure of Bitumen: Consequences on the Rheology and on the Mechanisms of Bitumen Modification[J]. Advances in Colloid and Interface Science, 2009, 145(1–2): 42-82

[18]

He L, Li G, Lv S, et al.. Self-healing Behavior of Asphalt System Based on Molecular Dynamics Simulation[J]. Construction and Building Materials, 2020, 254: 119 225

[19]

Zhao K, Wang W, Wang L. Fatigue Damage Evolution and Self-healing Performance of Asphalt Materials under Different Influence Factors and Damage Degrees[J]. International Journal of Fatigue, 2023, 171: 107 577

RIGHTS & PERMISSIONS

Wuhan University of Technology and Springer-Verlag GmbH Germany, Part of Springer Nature

PDF

27

Accesses

0

Citation

Detail

Sections
Recommended

/