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Z(2) Invariance of Germanene on MoS2 from First Principles

Autor(en)
Taher Amlaki, Menno Bokdam, Paul J. Kelly
Abstrakt

We present a low energy Hamiltonian generalized to describe how the energy bands of germanene ((Ge) over bar) are modified by interaction with a substrate or a capping layer. The parameters that enter the Hamiltonian are determined from first-principles relativistic calculations for (Ge) over bar vertical bar MoS2 bilayers and MoS2 vertical bar(Ge) over bar vertical bar MoS2 trilayers and are used to determine the topological nature of the system. For the lowest energy, buckled germanene structure, the gap depends strongly on how germanene is oriented with respect to the MoS2 layer(s). Topologically nontrivial gaps for bilayers and trilayers can be almost as large as for a freestanding germanene layer.

Organisation(en)
Computergestützte Materialphysik
Externe Organisation(en)
University of Twente
Journal
Physical Review Letters
Band
116
Anzahl der Seiten
6
ISSN
0031-9007
DOI
https://doi.org/10.1103/PhysRevLett.116.256805
Publikationsdatum
06-2016
Peer-reviewed
Ja
ÖFOS 2012
103025 Quantenmechanik, 103036 Theoretische Physik, 103015 Kondensierte Materie, 103009 Festkörperphysik
Schlagwörter
ASJC Scopus Sachgebiete
Allgemeine Physik und Astronomie
Link zum Portal
https://ucrisportal.univie.ac.at/de/publications/f4369ee4-08a3-4ae1-a306-3cc1941eac4a