Coordination effects on the binding of late 3d single metal species to cyanographene-Reference-Cited by-同舟云学术

Coordination effects on the binding of late 3d single metal species to cyanographene

Published:2023 Issue:1 Volume:25 Page:286-296
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Průcha Róbert¹,Hrubý Vítězslav²³,Zaoralová Dagmar⁴,Otyepková Eva³^ORCID,Šedajová Veronika²³^ORCID,Kolařík Jan²,Zbořil Radek²⁵^ORCID,Medved’ Miroslav¹²^ORCID,Otyepka Michal²⁴^ORCID

Affiliation:

1. Department of Chemistry, Faculty of Natural Sciences, Matej Bel University, Tajovského 40, 974 01 Banská Bystrica, Slovak Republic

2. Regional Centre of Advanced Technologies and Materials, Czech Advanced Technology and Research Institute, Palacky University Olomouc, Křížkovského 511/8, 77900 Olomouc, Czech Republic

3. Department of Physical Chemistry, Faculty of Science, Palacký University Olomouc, 17. listopadu 12, 711 46 Olomouc, Czech Republic

4. IT4Innovations, VŠB—Technical University of Ostrava, 17. listopadu 2172/15, 708 00 Ostrava-Poruba, Czech Republic

5. Nanotechnology Centre, VŠB – Technical University of Ostrava, 17. listopadu 2172/15, 708 00 Ostrava-Poruba, Czech Republic

Abstract

Coordination significantly affects the stability of single metals anchored to 2D materials. DFT applied to models including a coordination sphere and solvation effects predicts the binding affinities of late 3d cations consistently with experiment.

Funder

Ministerstvo Školství, Mládeže a Tělovýchovy

Univerzita Palackého v Olomouci

H2020 European Research Council

European Cooperation in Science and Technology

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/D2CP04076J

Reference47 articles.