Articles with "properties orthorhombic" as a keyword



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Orthorhombic CsPbI3 perovskites: Thickness-dependent structural, optical and vibrational properties

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Published in 2020 at "Computational Condensed Matter"

DOI: 10.1016/j.cocom.2019.e00453

Abstract: Abstract Cesium lead halide perovskites have been subject to intense investigation, mostly because of their potential to be used in optoelectronic device applications. However, regarding the need for nanoscale materials in forthcoming nanotechnology applications, understanding… read more here.

Keywords: properties orthorhombic; vibrational properties; cspbi3 perovskites; orthorhombic cspbi3 ... See more keywords
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Effective mass and optical properties of orthorhombic Al1−xInxFeO3 perovskite: An ab-initio study

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Published in 2019 at "Computational Materials Science"

DOI: 10.1016/j.commatsci.2018.12.012

Abstract: Abstract Electronic and optical properties of AlFeO3 and Al1−xInxFeO3 (x = 0.25, 0.5, 0.75) are studied using ab-initio calculations. Electronic structure in the vicinity of the conduction band minimum (CBM) and valence band maximum (VBM), the effective… read more here.

Keywords: properties orthorhombic; al1 xinxfeo3; mass optical; optical properties ... See more keywords
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Intrinsic structural distortion assisted optical and magnetic properties of orthorhombic rare-earth perovskite La1-xEuxCrO3: Effect of t-e hybridization

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Published in 2021 at "Journal of Alloys and Compounds"

DOI: 10.1016/j.jallcom.2020.156748

Abstract: Abstract Nanocrystalline orthochromatic perovskite structured La1-xEuxCrO3 (x = 0.0, 0.01, 0.03 and 0.05) compounds have been prepared via a solid-state reaction method calcined at a temperature 1200 °C. Here, we investigate the influence of Eu3+ on the structural,… read more here.

Keywords: intrinsic structural; la1 xeuxcro3; properties orthorhombic; magnetic properties ... See more keywords
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Magnetic and transport properties of orthorhombic rare-earth aluminum germanide GdAlGe

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Published in 2021 at "Journal of Magnetism and Magnetic Materials"

DOI: 10.1016/j.jmmm.2021.167739

Abstract: Abstract The structure, magnetic and transport properties of the orthorhombic rare-earth aluminum germanide GdAlGe are systematically studied using X-ray diffraction, scanning electron microscopy (SEM), magnetic and electric measurements. A phase transition from tetragonal to orthorhombic… read more here.

Keywords: transport properties; properties orthorhombic; magnetic transport; gdalge ... See more keywords
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Theoretical studies on the structural, electronic and optical properties of orthorhombic perovskites CH 3 NH 3 PbX 3 (X = I, Br, Cl)

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Published in 2017 at "Journal of Physics and Chemistry of Solids"

DOI: 10.1016/j.jpcs.2017.05.005

Abstract: Abstract In this study, we report advanced density functional theory (DFT) calculations on the structural, electronic, and optical properties of orthorhombic perovskite CH 3 NH 3 PbX 3 ( X = I , Br ,… read more here.

Keywords: theoretical studies; structural electronic; properties orthorhombic; optical properties ... See more keywords
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Ab initio study of elastic properties of orthorhombic cadmium stannate as a substrate for the manufacture of MEMS devices

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Published in 2020 at "Materials today communications"

DOI: 10.1016/j.mtcomm.2020.101822

Abstract: Abstract The elastic properties of the orthorhombic cadmium stannate (Cd2SnO4) were investigated using density functional theory, applying both energy-strain relationship (which is found in the literature) and stress-strain relationship (which we have developed in this… read more here.

Keywords: properties orthorhombic; manufacture; study; cadmium stannate ... See more keywords
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The structural, elastic, electronic and optical properties of orthorhombic FeX 2 (X=S, Se, Te)

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Published in 2018 at "Superlattices and Microstructures"

DOI: 10.1016/j.spmi.2018.04.042

Abstract: Abstract The structural, elastic, electronic and optical properties of FeX2 (X = S, Se, Te) with orthorhombic (space group Pnnm) structure have been investigated through the first-principles calculations. The calculated lattice constants, internal structure parameters and two… read more here.

Keywords: structural elastic; three compounds; properties orthorhombic; optical properties ... See more keywords
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Electronic and optical properties of orthorhombic (CH3NH3)BX3 (B = Sn, Pb; X = F, Cl, Br, I) perovskites: a first-principles investigation

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Published in 2021 at "RSC Advances"

DOI: 10.1039/d1ra01586a

Abstract: The electronic and optical properties of orthorhombic (CH3NH3)BX3 (B = Sn, Pb; X = F, Cl, Br, I) were investigated by first-principles density functional theory. read more here.

Keywords: properties orthorhombic; optical properties; electronic optical; ch3nh3 bx3 ... See more keywords
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Properties of orthorhombic Ga2O3 alloyed with In2O3 and Al2O3

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Published in 2021 at "Applied Physics Letters"

DOI: 10.1063/5.0060801

Abstract: Ga2O3 is a promising wide-bandgap material for electronic applications. The metastable orthorhombic κ phase is of particular interest due to its large predicted spontaneous electrical polarization. Here, we investigate how the properties of the orthorhombic… read more here.

Keywords: in2o3; orthorhombic ga2o3; properties orthorhombic; ga2o3 alloyed ... See more keywords