首页> 外文会议>Technical Meeting of the Eastern States Section of the Combustion Institute >A Betweenness Centrality Method for Chemical Network Analysis and Mechanism Reduction
【24h】

A Betweenness Centrality Method for Chemical Network Analysis and Mechanism Reduction

机译:化学网络分析与化学网络分析的间平方法

获取原文

摘要

A new method based on the concept of betweenness centrality was developed for chemical network analysis and skeletal reduction. After establishing the graphical representation of a chemical network, the betweenness centrality is defined to rank species for removal. It then shows that such a definition takes into account of the fluxes between species as well as their positioning within a chemical network, which are not fully considered by existing methods. Autoignition using GRI 3.0 detailed mechanism of methane oxidation is then used to demonstrate the concept as well as the reduction procedure. The index of importance based on the betweenness centrality is calculated to show the controlling chemistry. Skeletal mechanisms of different sizes based on such an index with further optimization are constructed for each case. Based on the retention frequency of each species in all cases, a global skeletal mechanism is eventually constructed and validated for autoignition, perfectly stirred reactors and laminar flames in a large parameter range of pressure from 0.1 to 30 atm, temperature from 1000 to 1600K, and equivalence ratio from 0.5 to 1.5, showing satisfactory performance.
机译:为化学网络分析和骨骼减少开发了一种基于中心地位概念的新方法。在建立化学网络的图形表示之后,将中心性之间定义为排序的等级。然后,它表明,这种定义考虑了物种之间的助熔剂以及它们在化学网络内的定位,这不受现有方法完全考虑的。使用GRI 3.0自燃3.0甲烷氧化的详细机制,用于展示概念以及还原过程。计算基于中心性之间的重要性的重要性,以显示控制化学。基于这种指数的不同尺寸的骨骼机制为每种情况都构造了进一步优化。基于所有情况下每种物种的保留频率,最终形成并验证全局骨骼机制,对自燃,完美搅拌的反应器和层状火焰在大的压力范围内的压力范围为0.1至30atm,温度为1000至1600k,从0.5到1.5的等效比,显示出令人满意的性能。

著录项

相似文献

  • 外文文献
  • 中文文献
  • 专利
获取原文

客服邮箱:kefu@zhangqiaokeyan.com

京公网安备:11010802029741号 ICP备案号:京ICP备15016152号-6 六维联合信息科技 (北京) 有限公司©版权所有
  • 客服微信

  • 服务号