ArticleAdvanced science (Weinheim, Baden-Wurttemberg, Germany)2024
Bilayer Kagome Borophene with Multiple van Hove Singularities.
Article in Advanced science (Weinheim, Baden-Wurttemberg, Germany), 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.
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1 citing paper in PubMed.
- Bilayer Kagome Borophene with Multiple van Hove Singularities.Advanced science (Weinheim, Baden-Wurttemberg, Germany) · 2024Article
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4 authors.
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Abstract
The appearance of van Hove singularities near the Fermi level leads to prominent phenomena, including superconductivity, charge density wave, and ferromagnetism. Here a bilayer Kagome lattice with multiple van Hove singularities is designed and a novel borophene with such lattice (BK-borophene) is proposed by the first-principles calculations. BK-borophene, which is formed via three-center two-electron (3c-2e) σ-type bonds, is predicted to be energetically, dynamically, thermodynamically, and mechanically stable. The electronic structure hosts both conventional and high-order van Hove singularities in one band. The conventional van Hove singularity resulting from the horse saddle is 0.065 eV lower than the Fermi level, while the high-order one resulting from the monkey saddle is 0.385 eV below the Fermi level. Both the singularities lead to the divergence of electronic density of states. Besides, the high-order singularity is just intersected to a Dirac-like cone, where the Fermi velocity can reach 1.34 × 10
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