Electronic effects due to organic linker-metal surface interactions: implications on screening of MOF-encapsulated catalysts-Reference-Cited by-同舟云学术

Electronic effects due to organic linker-metal surface interactions: implications on screening of MOF-encapsulated catalysts

Published:2020 Issue:4 Volume:22 Page:2475-2487
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Schweitzer Benjamin¹²³⁴,Archuleta Chloe¹²³⁴,Seong Bomsaerah¹²³⁴,Anderson Ryther¹²³⁴,Gómez-Gualdrón Diego A.¹²³⁴^ORCID

Affiliation:

1. Department of Chemical and Biological Engineering

2. Colorado School of Mines

3. Golden CO 80401

4. USA

Abstract

Using approximated NP/MOF interface models, DFT was used to investigate MOF-originated electronic effects on encapsulated NPs in NP@MOF hybrid catalysts.

Funder

Division of Chemical, Bioengineering, Environmental, and Transport Systems

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/C9CP05380H

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