聚合体与硅酸钙水合物相互作用的分子动力学模拟及乙烯-醋酸乙烯共聚物改性剂的影响

IF 1.9 4区化学 Q4 CHEMISTRY, PHYSICAL

Molecular Simulation Pub Date : 2024-04-30 DOI:10.1080/08927022.2024.2338606

Dajing Qin, Yong Feng, Lijuan Li

引用次数: 0

摘要

众所周知，骨料/水泥界面的粘结强度会影响混凝土的整体耐久性。然而，乙烯-醋酸乙烯（EVA）共聚物的改性是否会影响混凝土的整体耐久性？

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Molecular dynamics simulation of the interaction between aggregates and calcium silicate hydrate and influence of ethylene vinyl acetate copolymer modifier

It is known that the bonding strength of the aggregate/cement interface affects the overall durability of concrete. However, whether the modification of ethylene vinyl acetate (EVA) copolymer affec...

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来源期刊

Molecular Simulation 化学-物理：原子、分子和化学物理

CiteScore

3.80

自引率

9.50%

发文量

128

审稿时长

3.1 months

期刊介绍： Molecular Simulation covers all aspects of research related to, or of importance to, molecular modelling and simulation. Molecular Simulation brings together the most significant papers concerned with applications of simulation methods, and original contributions to the development of simulation methodology from biology, biochemistry, chemistry, engineering, materials science, medicine and physics. The aim is to provide a forum in which cross fertilization between application areas, methodologies, disciplines, as well as academic and industrial researchers can take place and new developments can be encouraged. Molecular Simulation is of interest to all researchers using or developing simulation methods based on statistical mechanics/quantum mechanics. This includes molecular dynamics (MD, AIMD), Monte Carlo, ab initio methods related to simulation, multiscale and coarse graining methods.