The influence of force fields on the structure and dynamics of water confined in ZIF-8 from atomistic simulations-Reference-Cited by-同舟云学术

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The influence of force fields on the structure and dynamics of water confined in ZIF-8 from atomistic simulations

Published:2023 Issue:34 Volume:25 Page:23100-23110
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Wang Jing¹,Xie Shi-Jie¹^ORCID

Affiliation:

1. Center for Membrane Separation and Water Science & Technology, Zhejiang University of Technology, Hangzhou 310014, P. R. China

Abstract

The choice of force fields does not affect the qualitative description of the mechanism of water diffusion in ZIF-8.

Funder

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP02075D

Reference70 articles.

1. Synthesis, Structure, and Carbon Dioxide Capture Properties of Zeolitic Imidazolate Frameworks

2. Exceptional chemical and thermal stability of zeolitic imidazolate frameworks

3. Investigating the Pressure-Induced Amorphization of Zeolitic Imidazolate Framework ZIF-8: Mechanical Instability Due to Shear Mode Softening

4. Current Perspectives and Mini Review on Zeolitic Imidazolate Framework-8 (ZIF-8) Membranes on Organic Substrates

5. A mini‐review and recent outlooks on the synthesis and applications of zeolite imidazolate framework‐8 ( ZIF ‐8) membranes on polymeric substrate

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