QM-MM Approach to the Accurate Description of Slow Diffusion in Porous Materials-Reference-Cited by-同舟云学术

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QM-MM Approach to the Accurate Description of Slow Diffusion in Porous Materials

Published:2023-04-26 Issue:18 Volume:127 Page:8856-8863
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Trachta Michal¹,Volný Tomáš¹^ORCID,Rubeš Miroslav¹²^ORCID,Bulánek Roman²^ORCID,Bludský Ota¹^ORCID

Affiliation:

1. Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic, Flemingovo nám. 2, 162 10 Prague, Czech Republic

2. Department of Physical Chemistry, Faculty of Chemical Technology, University of Pardubice, Studentská 573, 532 10 Pardubice, Czech Republic

Funder

Grantov? Agentura Cesk? Republiky

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.3c01340

Reference64 articles.

1. Synthesis and performance evaluation of hydrocracking catalysts: A review

2. Efficient kinetic separation of propene and propane using two microporous metal organic frameworks

3. Incommensurate Diffusion in Confined Systems

4. Discriminative Separation of Gases by a “Molecular Trapdoor” Mechanism in Chabazite Zeolites

5. Carbonate-Promoted Drift of Alkali Cations in Small Pore Zeolites: Ab Initio Molecular Dynamics Study of CO2 in NaKA Zeolite

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1. Confinement-Driven Dimethyl Ether Carbonylation in Mordenite Zeolite as an Ultramicroscopic Reactor;Accounts of Chemical Research;2024-08-27

2. Strong CO2 adsorption in narrow-pore ADOR zeolites: A combined experimental and computational study on IPC-12 and related structures;Journal of CO2 Utilization;2023-08

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