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Preferential Positioning, Stability, and Segregation of Dopants in Hexagonal Si Nanowires
摘要： We studied the physics of common p- and n-type dopants in hexagonal-diamond Si –a Si polymorph that can be synthesized in nanowire geometry without the need of extreme pressure conditions– by means of first-principles electronic structure calculations and compared our results with those for the well-known case of cubic-diamond nanowires. We showed that i) as observed in recent experiments, at larger diameters (beyond the quantum confinement regime) p-type dopants prefer the hexagonal-diamond phase with respect to the cubic one as a consequence of the stronger degree of three-fold coordination of the former, while n-type dopants are at a first approximation indifferent to the polytype of the host lattice; ii) in ultra-thin nanowires, because of the lower symmetry with respect to bulk systems and the greater freedom of structural relaxation, the order is reversed and both types of dopant slightly favor substitution at cubic lattice sites; iii) the difference in formation energies leads, particularly in thicker nanowires, to larger concentration differences in different polytypes, which can be relevant for cubic-hexagonal homojunctions; iv) ultra-small diameters exhibit, regardless of the crystal phase, a pronounced surface segregation tendency for p-type dopants. Overall these findings shed light on the role of crystal phase in the doping mechanism at the nanoscale and could have a great potential in view of the recent experimental works on group IV nanowires polytypes.
关键词： density functional theory,Nanowires,formation energy,dopants,2H-Si,hexagonal diamond silicon
更新于2025-09-23 15:23:52
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3D core-multishell piezoelectric nanogenerators
摘要： The thin film configuration presents obvious practical advantages over the 1D implementation in energy harvesting systems such as easily manufacturing and processing, and long-lasting and stable devices. However, ZnO-based piezoelectric nanogenerators (PENGs) generally rely on the exploitation of single-crystalline nanowires because of their self-orientation in the c-axis direction and ability to accommodate long deformations resulting in high piezoelectric performance. Herein, we show an innovative approach to produce PENGs by combining polycrystalline ZnO layers fabricated at room temperature by plasma-assisted deposition with supported small-molecule organic nanowires (ONWs) acting as 1D scaffolds. Such hybrid nanostructures present convoluted core-shell morphology, formed by a single-crystalline organic nanowire conformally surrounded by a poly-crystalline ZnO shell and combine the organic core mechanical properties with the ZnO layer piezoelectric response. In a step forward towards the integration of multiple functions within a single wire, we have also developed ONW-Au-ZnO nanoarchitectures including a gold shell acting as inner electrode achieving output piezo-voltages up to 170 mV. The synergistic combination of functionalities in the ONW-Au-ZnO devices promotes an enhanced performance generating piezo-currents one order of magnitude larger than the ONW-ZnO nanowires and superior to the thin film nanogenerators for equivalent and higher thicknesses.
关键词： piezoelectric nanogenerators,organic nanowires,ZnO,small-molecules,plasma deposition,core-shell nanowires
更新于2025-09-23 15:22:29
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Nanostructuring Strategies To Increase the Photoelectrochemical Water Splitting Activity of Silicon Photocathodes
摘要： Photoelectrochemical water splitting is a promising route for sustainable hydrogen production. Herein, we demonstrate a photoelectrode motif that enables a nanostructured large-surface area electrocatalyst without requiring a nanostructured semiconductor surface with the goal of promoting electrocatalysis while minimizing surface recombination. We compare the photoelectrochemical H2 evolution activity of two silicon photocathode nanostructuring strategies: (1) direct nanostructuring of the silicon surface and (2) incorporation of nanostructured zinc oxide to increase the electrocatalyst surface area on planar silicon. We observed that silicon photocathodes that utilized nanostructured ZnO supports outperformed nanostructured silicon electrodes by ～50 mV at open circuit under 1 sun illumination and demonstrated comparable electrocatalytic activity.
关键词： photocathodes,silicon nanowires,hydrogen evolution,molybdenum disulfide,zinc oxide nanowires,photoelectrochemical water splitting
更新于2025-09-23 15:22:29
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Effective light polarization insensitive and omnidirectional properties of Si nanowire arrays developed on different crystallographic planes
摘要： In this paper, fabrication of vertical Si nanowire arrays (SiNWAs) by a facile metal assisted electroless etching approach on different crystallographic planes of Si has been reported. A very low specular reflectance (Rspec) of 0.04% and 0.03% has been achieved in the whole visible range for SiNWAs grown on Si(100) and Si(111) oriented substrates, respectively. High broadband enhancement has been detected for vertical SiNWAs due to multiple scattering paths inside the nanowire arrays. On the other hand, inclined nanowires showed a fascinating behavior at the longer wavelength regime, where light gets the longer path to reflect back-forth and ease to reflect back outward at normal incidence. Moreover, for [100] SiNWAs, transverse electric (TE) field component demonstrates the strong polarization insensitive properties at the expense of transverse magnetic (TM) field component with a minimum reflectance of < 2% up to 1200 nm. The [100] SiNWAs demonstrates extra-ordinary omnidirectional properties at θB ≥ 58o. Theoretical validation of COMSOL with an effective medium approach reveal the effective dipole coupling and the presence of strong absorption modes for vertical SiNWs at a typical wavelength regime. The highly bound states of the particle tunneling through classical forbidden region shows a strong enhancement in light absorption effect.
关键词： nanocavities,Si nanowires,light coupling effect,omnidirectional,polarization
更新于2025-09-23 15:22:29
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Silver Nanowires Inks for Flexible Circuit on Photographic Paper Substrate
摘要： Silver nanowires (AgNWs) have inspired many research interests due to their better properties in optical, electric, and flexible applications. One such exploitable use is as the electrical conductive fillers for print electronics. In this paper, AgNWs with mean a diameter of 80 nm and mean length of 13.49 μm were synthesized using the polyol solvothermal method. A sonication-induced scission process was used to obtain AgNWs with a length range of 7.64–11.21 μm. Further AgNWs inks were prepared with the as-synthesized AgNWs as conductive fillers in anhydrous ethanol. The conductive inks were coated on resin coated photographic paper substrate using the knife coating process and dried at room temperature. The effects of the number of layers of AgNWs coating, the concentration of AgNWs, and the length of AgNWs on the microstructure and electrical properties of samples were investigated by scanning electron microscopy and using the four-point probe method. The results show that the conductivity of the AgNWs coating increases with the increase in the number of layers in the AgNWs coating, concentration and length of the AgNWs.
关键词： sheet resistance,silver nanowires inks,flexible circuit,photographic paper
更新于2025-09-23 15:22:29
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Mixed-metal organic framework-coated ZnO nanowires array for efficient photoelectrochemical water oxidation
摘要： Designing of high-performance photoanodes is essential for efficient solar energy conversion in photoelectrochemical (PEC) water splitting. Herein, we report an effective approach to synthesize three dimensional (3D) mixed-metal organic framework-coated ZnO nanowires array (ZnNi MOF@ZnO) for the effective PEC performance. The ZnO nanowires act as photon absorber as well as rapid charge transporter; whilst the ZnNi MOF provides the active sites for PEC process by lowering the energy barrier of water oxidation and suppressing electron-hole recombination. The 3D nanostructure of ZnNi MOF@ZnO nanowires array provides intimate interfacial contact through covalent interactions between the ZnNi MOF and ZnO nanowires which facilitates the rapid charge transfer during photocatalytic oxygen evolution reactions. As a result, the ZnNi MOF@ZnO nanowires array exhibited excellent photoelectrochemical water oxidation with very low onset potential (0.31 V vs. RHE) and high photocurrent density (1.40 mA/cm2) as compared to the Zn MOF @ZnO and ZnO nanowires array. This facile strategy provides a promising direction towards high performance photoanode design for adequate solar energy conversion.
关键词： Metal organic frameworks (MOFs),Photoelectrocatalyst,Nanowires array,Photoelectrochemical water oxidation,Photoanodes
更新于2025-09-23 15:22:29
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Catalytic synthesis of SiC nanowires in an open system
摘要： SiC nanowires (NWs) are usually synthesized in a closed vacuum reaction system which limits the yield of SiC NWs. In this work, SiC NWs and carbon nanotubes were synthesized in an open tube furnace at 1550 ℃ with Si powder as silicon sources, ethanol as carbon sources and ferrocene as catalyst. The as-synthesized products were ultralong β-SiC NWs with the diameter about 80-100 nm and the length up to several tens micrometers. The diameter of the carbon nanotubes was about 20-30 nm. The carbon nanotube yarns about 20 cm in length were obtained at the end of the tube furnace. The growth mechanism of SiC NWs and carbon nanotubes were proposed. Compared with the traditional synthetic techniques in the high vacuum closed system, the novel synthesis method in the open system provided a new approach to the synthesis of SiC NWs.
关键词： Carbon nanotubes,SiC nanowires,Open reaction system,Growth mechanism
更新于2025-09-23 15:22:29
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Synthesis of Tungsten Oxide Nanowires onto ITO Glass Using T-CVD
摘要： Tungsten oxide is an n-type semiconductor with interesting physical and chemical properties that make it suitable for various technological applications. Tungsten oxide nanowires were synthesized not only at low temperature but also without the use of any catalysts. The tungsten oxide nanowires were synthesized at 550 °C with tungsten layers onto the ITO glass using thermal chemical vapor deposition (T-CVD). The SEM image shows that the tungsten oxide nanowires are effectively grown with the 200 nm tungsten film. The Raman spectra shoulder at ~690 cm-1 proves the synthesized of tungsten oxide nanowires.
关键词： ITO glass,thermal chemical vapor deposition,Tungsten oxide nanowires
更新于2025-09-23 15:22:29
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Nanoscopic Spotlight in a Spindle Semiconductor Nanowire
摘要： Theoretically, no matter how thin a nanowire is, it can transport light in the form of an evanescent field. However, in practice, the low propagation efficiency induced by complex dissipation makes light transport difficult to realize when the nanowire is distinctly thinner than ~λ/2. Accordingly, nanowire photonics research at such a scale is limited. Herein, light propagation was achieved in a very thin spindle nanowire (diameter below 70 nm), in which a nanoscopic spotlight formed. The nanowire output a maximum emission in the transverse dimension as small as ~53 nm. The finite-difference time-domain (FDTD) simulation implied that the increased dimension gradient near the tip induced a maximum leakage of the propagating light at a transverse feature, precisely determined by the intrinsic feature of the nanowire. Moreover, a spectrum splitter phenomenon was observed and demonstrated based on the wavelength-dependent light propagation behavior in such a nanowire. These results contribute to the rational design of nanoscopic near-field illuminant, optoelectric and photobiological probes with improved resolution largely superior to the so-called subwavelength level.
关键词： semiconductors,nanoscopic light,light waveguide,nanowires,photonic property
更新于2025-09-23 15:22:29
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Semimetallicity and Negative Differential Resistance from Hybrid Halide Perovskite Nanowires
摘要： In the rapidly progressing field of organometal halide perovskites, the dimensional reduction can open up new opportunities for device applications. Herein, taking the recently synthesized trimethylsulfonium lead triiodide (CH3)3SPbI3 perovskite as a representative example, first-principles calculations are carried out and the nanostructuring and device application of halide perovskite nanowires are studied. It is found that the 1D (CH3)3SPbI3 structure is structurally stable, and the electronic structures of higher-dimensional forms are robustly determined at the 1D level. Remarkably, due to the face-sharing [PbI6] octahedral atomic structure, the organic ligand-removed 1D PbI3 frameworks are also found to be stable. Moreover, the PbI3 columns avoid the Peierls distortion and assume a semimetallic character, contradicting the conventional assumption of semiconducting metal-halogen inorganic frameworks. Adopting the bundled nanowire junctions consisting of (CH3)3SPbI3 channels with sub-5 nm dimensions sandwiched between PbI3 electrodes, high current densities and large room-temperature negative differential resistance (NDR) are finally obtained. It will be emphasized that the NDR originates from the combination of the near-Ohmic character of PbI3-(CH3)3SPbI3 contacts and a novel NDR mechanism that involves the quantum-mechanical hybridization between channel and electrode states. This work demonstrates the great potential of low-dimensional hybrid perovskites toward advanced electronic devices beyond actively pursued photonic applications.
关键词： semimetals,halide perovskite nanowires,first-principles calculations,negative differential resistance
更新于2025-09-23 15:22:29