Please use this identifier to cite or link to this item: https://hdl.handle.net/11147/6169
Title: Computing optical properties of ultra-thin crystals
Authors: Şahin, Hasan
Torun, Engin
Bacaksız, Cihan
Horzum, Şeyda
Kang, J.
Senger, Ramazan Tuğrul
Peeters, François M.
Keywords: Boron nitride
Computation theory
Crystal atomic structure
Density functional theory
Issue Date: Jul-2016
Publisher: John Wiley and Sons Inc.
Source: Şahin, H., Torun, E., Bacaksız, C., Horzum, Ş., Kang, J., Senger, R. T., and Peeters, F. M. (2016). Computing optical properties of ultra-thin crystals. Wiley Interdisciplinary Reviews: Computational Molecular Science, 6(4), 351-368. doi:10.1002/wcms.1252
Abstract: An overview is given of recent advances in experimental and theoretical understanding of optical properties of ultra-thin crystal structures (graphene, phosphorene, silicene, MoS2 , MoSe2 , WS2 , WSe2 , h-AlN, h-BN, fluorographene, and graphane). Ultra-thin crystals are atomically thick-layered crystals that have unique properties which differ from their 3D counterpart. Because of the difficulties in the synthesis of few-atom-thick crystal structures, which are thought to be the main building blocks of future nanotechnology, reliable theoretical predictions of their electronic, vibrational, and optical properties are of great importance. Recent studies revealed the reliable predictive power of existing theoretical approaches based on density functional theory.
URI: http://doi.org/10.1002/wcms.1252
http://hdl.handle.net/11147/6169
ISSN: 1759-0876
Appears in Collections:Physics / Fizik
Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection
WoS İndeksli Yayınlar Koleksiyonu / WoS Indexed Publications Collection

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