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Establishing Discrete Ising Model for Zeolite Deactivation: Inspiration from the Game of Go

Abstract

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

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Publication details

The article was received on 21 Feb 2017, accepted on 19 Apr 2017 and first published on 20 Apr 2017


Article type: Communication
DOI: 10.1039/C7CY00331E
Citation: Catal. Sci. Technol., 2017, Accepted Manuscript
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    Establishing Discrete Ising Model for Zeolite Deactivation: Inspiration from the Game of Go

    D. Cai, Y. Ma, Y. Hou, Y. Cui, Z. Jia, C. Zhang, Y. Wang and F. Wei, Catal. Sci. Technol., 2017, Accepted Manuscript , DOI: 10.1039/C7CY00331E

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