Multi-scale computational investigation of Ag-doped two-dimensional Zn-based MOFs for storage and release of small NO and CO bioactive molecules-Reference-Cited by-同舟云学术

Multi-scale computational investigation of Ag-doped two-dimensional Zn-based MOFs for storage and release of small NO and CO bioactive molecules

Published:2023 Issue:4 Volume:25 Page:2830-2845
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Naderlou Shabnam¹^ORCID,Vahedpour Morteza¹,Franz Douglas M.²^ORCID

Affiliation:

1. Department of Chemistry, University of Zanjan (ZNU), P.O. Box 38791-45371, Zanjan, Iran

2. Department of Chemistry, University of South Florida, 4202 East Fowler Avenue, CHE205, Tempa, FL 33620-5250, USA

Abstract

Strong dependence of the structural and dynamical properties of NO and CO on Ag-doped 2D-MOF. Effective adsorption of gas molecules on the two-sided Ag-doped benzene ring. Increasing the adsorption capacities of small gases in Ag-(Zn)-MOF.

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/D2CP04725J

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