对于高级工程应用的正方形-六角形链的拓指数的结构探索和预期值2,3
Salma Kanwal1, Maham Khalil1, Asima Razzaque2
1Department of Mathematics, Lahore College for Women University, Lahore, Punjab 54000 Pakistan.
ACS omega
|January 8, 2026
概括
方形-六角形链,化学多样性的模型,显示拓学如何影响分子性质. 这项研究分析了特定的扭曲链,计算了准确和预期的拓指数,以揭示结构-属性关系.
科学领域:
- 化学图形理论 化学图形理论
- 材料科学 材料科学 材料科学
- 纳米技术纳米技术
背景情况:
- 方形-六角形链平衡了几何规律性和拓复杂性.
- 这些结构与石墨烯衍生物和多环碳化合物有关.
- 基克拓影响电子行为,和机械稳定性.
研究的目的:
- 构建和分析T2,3链的四种结构配置.
- 为了获得多个拓索引的确切表达式.
- 用概率方法计算这些指数的预期值.
主要方法:
- 系统的多边形附件来创建曲链的配置.
- 对几何算术,扎格勒布,被遗忘,总和连接,产品连接和原子键连接指数的确切公式的推导.
- 概率的顶点权重用于计算预期的拓指数值.
主要成果:
- 准确的表达式确定性和预期的拓指数得到了所有配置.
- 数字和图形分析揭示了趋势和极值.
- 量化了Kink拓对准确和预期拓描述符的影响.
结论:
- 该研究提供了对T2,3链中的拓指数的全面分析.
- 这些发现加深了对复杂分子架构中的结构属性关系的理解.
- 结果支持纳米材料设计和理论建模中的应用.
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