The journal of physical chemistry letters
Unveiling the Structural Factors Governing the Diffusion of Ethene in Small-Pore Zeolites through Machine Learning.
Jing Ping, Koki Muraoka, Zhendong Liu, Akira Nakayama
Published: 202510.1021/acs.jpclett.5c02629
Abstract
Investigating diffusion dynamics in nanoscale confined spaces of zeolites has long been of significant interest. Although zeolite structures are known to significantly influence their diffusion properties, determining how a specific structure impacts…
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