计算机辅助催化剂颗粒级设计的研究

ON COMPUTER-AIDED CATALYST PELLET DESIGN

在深入研究催化剂颗粒级设计问题的模型化基础上,应用面向用户的计算机软件系统ESTRECAP分析了活性分布、多稳态等复杂问题,进一步讨论了相关的单颗粒催化剂导向性设计的方法和策略.

On the basis of the analysis of the modelling of catalyst pellets for catalyst design purposes, several complex problems like activity distribution and multiplicity in catalyst pellets are investigated by using a user-oriented computer program, ESTRECAP. Furthermore, the strategy of directed catalyst pellet design is outlined with two model systems.