Electronic band structure change with structural transition of buckled Au<sub>2</sub>X monolayers induced by strain-Reference-Cited by-同舟云学术

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Electronic band structure change with structural transition of buckled Au₂X monolayers induced by strain

Published:2024 Issue:4 Volume:26 Page:3367-3374
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Fukuda Masahiro¹^ORCID,Ozaki Taisuke¹

Affiliation:

1. Institute for Solid State Physics, The University of Tokyo, 5-1-5 Kashiwanoha, Kashiwa, Chiba 277-8581, Japan

Abstract

Compressive biaxial strain causes the phase transition from η-Au2S to θ-Au2S. The band structure and bandgap of Au2S are changed drastically under strain because of the phase transition.

Funder

Japan Society for the Promotion of Science

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D3CP03135G

Reference32 articles.

1. Topology-Scaling Identification of Layered Solids and Stable Exfoliated 2D Materials

2. The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals

3. A library of atomically thin metal chalcogenides

4. A structure map for AB2 type 2D materials using high-throughput DFT calculations

5. Our AB2 structure map and database are available on the interactive website , https://www.openmx-square.org/2d-ab2/

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