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https://dx.doi.org/10.48550/ar...
Article . 2019
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Spectroscopic properties of few-layer tin chalcogenides

Authors: Dewandre, Antoine; Verstraete, Matthieu; Grobert, Nicole; Zanolli, Zeila;

Spectroscopic properties of few-layer tin chalcogenides

Abstract

Abstract Stable structures of layered SnS and SnSe and their associated electronic and vibrational spectra are predicted using first-principles DFT calculations. The calculations show that both materials undergo a phase transformation upon thinning whereby the in-plane lattice parameters ratio a/b converges towards 1, similar to the high-temperature behaviour observed for their bulk counterparts. The electronic properties of layered SnS and SnSe evolve to an almost symmetric dispersion whilst the gap changes from indirect to direct. Characteristic signatures in the phonon dispersion curves and surface phonon states where only atoms belonging to surface layers vibrate should be observable experimentally.

Countries
Belgium, Spain
Keywords

Electronic structure, Condensed Matter - Materials Science, Physique, Physics, Physique, chimie, mathématiques & sciences de la terre, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, 2D materials, Physical, chemical, mathematical & earth Sciences, MonoChalcogenides, Ab initio, Raman spectroscopy, Theoretical Spectroscopy, Monochalcogenides, Dielectric response, Nanomaterials

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
views
OpenAIRE UsageCountsViews provided by UsageCounts
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16
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