Undulated silicene and germanene freestanding layers: why not?


Journal

Journal of physics. Condensed matter : an Institute of Physics journal
ISSN: 1361-648X
Titre abrégé: J Phys Condens Matter
Pays: England
ID NLM: 101165248

Informations de publication

Date de publication:
08 May 2020
Historique:
pubmed: 14 1 2020
medline: 14 1 2020
entrez: 14 1 2020
Statut: ppublish

Résumé

Silicene and germanene freestanding layers are usually described as a honeycomb lattice formed by two hexagonal sub-lattices presenting a height difference, namely the layer buckling. In this work, first-principles calculations show that silicene and germanene can be rippled at 0 K with various wavelengths, without any compressive strain of the layer. For germanene, the height difference between two Ge atoms from the same sub-lattice can be as high as 4.7 [Formula: see text] for an undulation length of 81 [Formula: see text]. The deformations are related to slight (lower than 1.7°) bond angle modifications, and the energy cost is remarkably low, lying between 0.1 and 0.8 meV per atom. These undulations modify the electronic structure, opening a gap of 15 meV.

Identifiants

pubmed: 31931489
doi: 10.1088/1361-648X/ab6ae8
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

195503

Auteurs

M-C Hanf (MC)

Université de Haute Alsace, CNRS, IS2M UMR7361,68100 Mulhouse, France. Université de Strasbourg, France.

Classifications MeSH