Principles of isomer stability in small clusters-Reference-Cited by-同舟云学术

Principles of isomer stability in small clusters

Published:2023 Issue:7 Volume:4 Page:1746-1768
ISSN:2633-5409
Container-title:Materials Advances
language:en
Short-container-title:Mater. Adv.

Author:

Fisicaro Giuseppe¹^ORCID,Schaefer Bastian²,Finkler Jonas A.²^ORCID,Goedecker Stefan²^ORCID

Affiliation:

1. Consiglio Nazionale delle Ricerche, Istituto per la Microelettronica e Microsistemi (CNR-IMM), Z.I. VIII Strada 5, I-95121 Catania, Italy

2. Department of Physics, University of Basel, Klingelbergstrasse 82, CH-4056 Basel, Switzerland

Abstract

We unveil the principles of isomer stability in small clusters. Our conclusions are based on a extensive statistical analysis of various structural and electronic descriptors on a huge database of isomers generated by ab-initio structure predictions.

Funder

Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung

Centro Svizzero di Calcolo Scientifico

Publisher

Royal Society of Chemistry (RSC)

Subject

General Materials Science,Chemistry (miscellaneous)

Link

http://pubs.rsc.org/en/content/articlepdf/2023/MA/D2MA01088G

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