聚合物的碳基阻燃剂:一个自下而上的回顾
Guan Heng Yeoh1,2, Ivan Miguel De Cachinho Cordeiro1, Wei Wang1
1School of Mechanical and Manufacturing Engineering, University of New South Wales, Sydney, NSW, 2052, Australia.
Advanced materials (Deerfield Beach, Fla.)
|May 30, 2024
概括
本综述探讨了碳基阻燃剂,如聚合物的石墨烯和MXenes等. 分子动力学模拟揭示了它们的机制,有助于开发先进的阻燃材料.
科学领域:
- 材料科学 材料科学 材料科学
- 聚合物化学 聚合物化学
- 计算材料科学科学 计算材料科学
背景情况:
- 阻燃剂对于聚合物安全至关重要.
- 碳基材料提供有前途的阻燃性能.
- 需要对它们的机制进行分子理解.
研究的目的:
- 阐明聚合物中碳基阻燃剂的分子机制.
- 审查各种碳基 (石墨,石墨烯,CNTs,CDs,富勒伦) 和MXenes的性能.
- 突出计算材料科学在推进阻燃性方面的作用.
主要方法:
- 整体的表征结合了分析评估和计算材料科学.
- 审查有关碳基阻燃剂及其性能现有的文献.
- 利用分子动力学 (MD) 模拟来理解热阻力过程.
主要成果:
- 碳基阻燃剂,包括石墨烯和MXenes,增强了聚合物的可燃性.
- 模拟MD提供了洞察力,在分子层面的炭形成和化学反应.
- 功能化碳材料和MXenes具有卓越的阻燃性和多功能应用.
结论:
- 将实验数据与MD模拟相结合,可以更深入地了解阻燃机制.
- 这种综合方法促进了先进的阻燃聚合物的有针对性的开发.
- 未来的研究应该专注于以分子见解为指导的系统材料合成框架.
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