{"title":"Microstructural Simulations of Polymer Composites by a Viscoelastic Spring Lattice Model","authors":"Zhuoran Xu, Xu Hu, Yongmin Huang","doi":"10.1002/mats.202400025","DOIUrl":null,"url":null,"abstract":"<p>An improved viscoelastic spring lattice model is used to analyze the mechanical properties of polymer composites containing different microstructures, as exemplified by hydroxyl-terminated polybutadiene-based solid propellants. A drop-on-demand structural model is programmed using the C language to simulate the real solid propellant microstructure. The results show that increasing the particle content has a positive effect on the tensile strength of the propellant, but is detrimental to the ductility. The increase in particle size decreases the maximum tensile strength of the material, reflecting the importance of the dewetting process in the microstructure analysis. Finally, the model accurately predicts that initial defects have a destructive effect on the mechanical properties of the material.</p>","PeriodicalId":18157,"journal":{"name":"Macromolecular Theory and Simulations","volume":"33 5","pages":""},"PeriodicalIF":1.8000,"publicationDate":"2024-05-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Macromolecular Theory and Simulations","FirstCategoryId":"5","ListUrlMain":"https://onlinelibrary.wiley.com/doi/10.1002/mats.202400025","RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"POLYMER SCIENCE","Score":null,"Total":0}
引用次数: 0
Abstract
An improved viscoelastic spring lattice model is used to analyze the mechanical properties of polymer composites containing different microstructures, as exemplified by hydroxyl-terminated polybutadiene-based solid propellants. A drop-on-demand structural model is programmed using the C language to simulate the real solid propellant microstructure. The results show that increasing the particle content has a positive effect on the tensile strength of the propellant, but is detrimental to the ductility. The increase in particle size decreases the maximum tensile strength of the material, reflecting the importance of the dewetting process in the microstructure analysis. Finally, the model accurately predicts that initial defects have a destructive effect on the mechanical properties of the material.
使用改进的粘弹性弹簧晶格模型分析了含有不同微结构的聚合物复合材料的机械性能,以 HTPB 类固体推进剂为例。使用 C 语言编制了一个按需滴落结构模型,以模拟真实的固体推进剂微观结构。结果表明,增加颗粒含量对推进剂的拉伸强度有积极影响,但对延展性不利。颗粒尺寸的增加会降低材料的最大拉伸强度,这反映了微观结构分析中脱湿过程的重要性。最后,该模型准确预测了初始缺陷对材料力学性能的破坏性影响。保留所有权利
期刊介绍:
Macromolecular Theory and Simulations is the only high-quality polymer science journal dedicated exclusively to theory and simulations, covering all aspects from macromolecular theory to advanced computer simulation techniques.