Electronic and optical properties of Quasi-1D barium zinc chalcogenides Ba2ZnX3(X=S,Se,Te): A DFT approach
Sign Up to like & getrecommendations! Published in 2020 at "Solid State Sciences"
DOI: 10.1016/j.solidstatesciences.2020.106456
Abstract: Abstract We investigated structural, electronic and optical properties of quasi-one-dimensional barium zinc chalcogenides Ba 2 ZnS 3 , Ba 2 ZnSe 3 and Ba 2 ZnTe 3 using density functional theory as implemented in VASP.… read more here.
Keywords: barium zinc; zinc chalcogenides; optical properties; electronic optical ... See more keywords
Density functional study of structural, electronic and optical properties of quasi-one-dimensional compounds BaTiX3(X=S,Se)
Sign Up to like & getrecommendations! Published in 2021 at "Superlattices and Microstructures"
DOI: 10.1016/j.spmi.2021.106859
Abstract: Abstract Structural, electronic and optical properties of quasi-one-dimensional material BaTiSe 3 were investigated using density functional theory and were compared with that of BaTiS 3 , which is well known for exhibiting the highest broadband… read more here.
Keywords: quasi one; structural electronic; electronic optical; one dimensional ... See more keywords
Static properties of quasi-confined hard-sphere fluids
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Statistical Mechanics: Theory and Experiment"
DOI: 10.1088/1742-5468/ab3342
Abstract: Confined fluids display complex behavior due to layering and local packing. Here, we disentangle these effects by confining a hard-sphere fluid to the surface of a cylinder, such the circumference extends only over a few… read more here.
Keywords: confined hard; static properties; hard sphere; sphere fluids ... See more keywords
Probing the waveguiding properties of quasi-2D organic semiconductor through optical imaging
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DOI: 10.1088/2053-1591/ac0faf
Abstract: Though there have been many investigations focusing on organic semiconductors, how to fully probe their waveguiding properties is still rarely reported. In this work, the light propagation loss in the Znq2 samples was detected by… read more here.
Keywords: probing waveguiding; organic semiconductor; imaging; properties quasi ... See more keywords
Magnetic Properties of Quasi-One-Dimensional Crystals Formed by Graphene Nanoclusters and Embedded Atoms of the Transition Metals
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DOI: 10.3390/cryst9050251
Abstract: Using the density-matrix renormalization group method and quantum Monte Carlo simulation, we studied numerically the energy spectrum and thermodynamics of the quantum Heisenberg spin model for narrow graphene nanoribbons and their derivatives with periodically embedded… read more here.
Keywords: quasi one; transition metals; magnetic properties; one dimensional ... See more keywords