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Establishing a discrete Ising model for zeolite deactivation: inspiration from the game of Go†
Dali Cai,Yunhai Ma,Yilin Hou,Yu Cui,Zhao Jia,Chenxi Zhang,Yao Wang,Fei Wei
Catalysis Science & Technology Pub Date : 04/20/2017 00:00:00 , DOI:10.1039/C7CY00331E
Abstract

Herein, we have built a discrete Ising model for deactivation considering the cage connectivity, inspired by the game of Go. An analytical solution for a simplistic 1D model is found, and it shows good consistency with the experimental results over ZSM-12. Some anomalous pseudo-phase transition phenomena in the deactivation process and in the acid density are presented by modeling the deactivation of SAPO-34. This model may bring new methodologies to research on the zeolite deactivation mechanism.

Graphical abstract: Establishing a discrete Ising model for zeolite deactivation: inspiration from the game of Go
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