2022
DOI: 10.1016/j.jpcs.2022.110601
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First-principles insight into the interfacial properties of epitaxial Bi2O2X (X = S, Se, Te) on SrTiO3 substrates

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Cited by 7 publications
(6 citation statements)
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“…Recently, dibismuth dioxychalcogenides, Bi 2 O 2 Ch (Ch = S, Se, Te), and their 2D counterparts have garnered tremendous research interest due to their potential applications in thermoelectrics, ,, ferroelectrics, and optoelectronics. ,, Bi 2 O 2 (Se/Te) crystallizes in the body-centered tetragonal (SG: I 4/ mmm , Z = 1 formula units (fu) per primitive cell) anti-ThCr 2 Si 2 -type structure, while Bi 2 O 2 S prefers to crystallize in the low-symmetry primitive orthorhombic structure (SG: Pnmn , Z = 2 fu) per primitive cell) due to the stereochemically active 6s 2 lone pair of Bi 3+ cations. The stereochemically active lone pair creates a structural distortion, causing a material to crystallize in relatively low symmetry compared to materials with stereochemically inactive lone pairs. , The crystal structure of Bi 2 O 2 Ch consists of alternating Bi 2 O 2 and chalcogen (S/Se/Te) layers, which are held together by strong electrostatic forces , in contrast to van der Waals (vdW) interactions that are typically observed in layered materials. Infrared, Raman spectra, and strain effects on bulk and monolayer Bi 2 O 2 Ch crystals have been systematically investigated to explore their possible applications in nanoelectronics …”
Section: Introductionmentioning
confidence: 99%
“…Recently, dibismuth dioxychalcogenides, Bi 2 O 2 Ch (Ch = S, Se, Te), and their 2D counterparts have garnered tremendous research interest due to their potential applications in thermoelectrics, ,, ferroelectrics, and optoelectronics. ,, Bi 2 O 2 (Se/Te) crystallizes in the body-centered tetragonal (SG: I 4/ mmm , Z = 1 formula units (fu) per primitive cell) anti-ThCr 2 Si 2 -type structure, while Bi 2 O 2 S prefers to crystallize in the low-symmetry primitive orthorhombic structure (SG: Pnmn , Z = 2 fu) per primitive cell) due to the stereochemically active 6s 2 lone pair of Bi 3+ cations. The stereochemically active lone pair creates a structural distortion, causing a material to crystallize in relatively low symmetry compared to materials with stereochemically inactive lone pairs. , The crystal structure of Bi 2 O 2 Ch consists of alternating Bi 2 O 2 and chalcogen (S/Se/Te) layers, which are held together by strong electrostatic forces , in contrast to van der Waals (vdW) interactions that are typically observed in layered materials. Infrared, Raman spectra, and strain effects on bulk and monolayer Bi 2 O 2 Ch crystals have been systematically investigated to explore their possible applications in nanoelectronics …”
Section: Introductionmentioning
confidence: 99%
“…2D bismuth oxychalcogenides (Bi 2 O 2 X: X = S, Se, Te) are a novel class of highly anisotropic zipper layered ternary compound semiconductor materials that have attracted extensive attention in nanoelectronics and nano-photonics due to their unique crystallographic structure, extraordinary electrical properties, superior ferroelectric/ferroelasticity, potential photocatalytic activity, outstanding photo response, and excellent ambient stability. [1][2][3][4][5] In contrast to traditional 2D materials (i.e., graphene, [6] black phosphorus (BP), [7] topological insulators (TIs), [8] bismuthene, [9] etc. ), in which the layer-layer is held by Van der Waals forces, Bi 2 O 2 X is a revolutionary 2D material, in which the strong covalently bonded [Bi 2 O 2 ]n 2n+ layers are sandwiched by planar X (S, Se, Te)n 2n− layers with relatively weak electrostatic interaction forces.…”
Section: Introductionmentioning
confidence: 99%
“…Subsequently, we tried to synthesize the ultrathin films of layered Bi 2 O 2 Te by a CVD method on mica substrate, whose atomically flat surface and non-neutral layered feature are beneficial to lower the surface potential of 2D Bi 2 O 2 Te during CVD growth. As pointed out by the previous theoretical calculations, 26,31 the formation of stable Bi 2 O 2 Te is quite challenging for its narrow window of chemical potential and the existence of vairous binary phases. Here, two simple substances of Te and Bi 2 O 3 were chosen as evaporation sources (Figure 1c), which were separatedly located at two To verify the crystal structure and chemical compositions of as-synthesized 2D Bi 2 O 2 Te crystals, transmission electron microscope (TEM) imaging along two zone axes (namely [001] and [010]) were conducted.…”
mentioning
confidence: 99%
“…The aforementioned Bi 2 O 2 Se series’ works have led to increasing research interest in the investigation of the whole 2D Bi 2 O 2 X family, which possesses intriguing non-neutral crystal structures composed of alternatively stacked [Bi 2 O 2 ] n 2 n + layers and [X] n 2 n – layers, small electron effective mass, and tunable band gaps. Compared to Bi 2 O 2 Se, Bi 2 O 2 Te was predicted to have smaller effective mass, larger spin–orbit coupling, and ferroelectricity under in-plane stress, suggesting the possible rich physics and more excellent electrical properties. , However, few studies of Bi 2 O 2 Te have been done so far, probably attributed to its lack of efficient ways to achieve the growth of ultrathin Bi 2 O 2 Te films. Recent theoretical work on thermodynamics of growth in Bi 2 O 2 X family clearly pointed out that it is most difficult to synthesize stable Bi 2 O 2 Te because of the existence of various binary phases and the narrow window of chemical potential .…”
mentioning
confidence: 99%