Qualitative Evolution of Asymmetric Raman Line-Shape for NanoStructures

A qualitative evolution of an asymmetric Raman line-shape function from a Lorentzian line-shape is discussed here for application in low dimensional semiconductors. The step-by-step evolution reported here is based on the phonon confinement model which is successfully used in literature to explain the asymmetric Raman line-shape from semiconductor nanostructures. Physical significance of different terms in the theoretical asymmetric Raman line-shape has been explained here. Better understanding of theoretical reasoning behind each term allows one to use the theoretical Raman line-shape without going into the details of theory from first principle. This will enable one to empirically derive a theoretical Raman line-shape function for any material if information about its phonon dispersion relation, size dependence, etc., is known.     

Possible origin of ferromagnetism in antiferromagnetic orthorhombic-YFeO3: A first-principles study

Rare-earth orthoferrites (RFeO₃) are well-known for the antiferromagnetic ground state. However, some of the recent experimental results suggest that the few members of RFeO₃ family possess ferromagnetism. In the present investigation we report the possible origin of ferromagnetism in antiferromagnetic YFeO₃ using density functional theory. For this purpose, we have considered pure as well as self-doping in YFeO₃ i.e. by considering the point defect at Y, Fe and O sites. Our finding suggests that the point defects in YFeO₃ results in the mixed-valence state of Fe, which may result in ferromagnetism through Zener double exchange mechanism.     

High Performance Lithium‐Ion Batteries Using Layered 2H‐MoTe2 as Anode

The major challenges faced by candidate electrode materials in lithium‐ion batteries (LIBs) include their low electronic and ionic conductivities. 2D van der Waals materials with good electronic conductivity and weak interlayer interaction have been intensively studied in the electrochemical processes involving ion migrations. In particular, molybdenum ditelluride (MoTe₂) has emerged as a new material for energy storage applications. Though 2H‐MoTe₂ with hexagonal semiconducting phase is expected to facilitate more efficient ion insertion/deinsertion than the monoclinic semi‐metallic phase, its application as an anode in LIB has been elusive. Here, 2H‐MoTe₂, prepared by a solid‐state synthesis route, has been employed as an efficient anode with remarkable Li⁺ storage capacity. The as‐prepared 2H‐MoTe₂ electrodes exhibit an initial specific capacity of 432 mAh g^?1 and retain a high reversible specific capacity of 291 mAh g^?1 after 260 cycles at 1.0 A g^?1. Further, a full‐cell prototype is demonstrated by using 2H‐MoTe₂ anode with lithium cobalt oxide cathode, showing a high energy density of 454 Wh kg^?1 (based on the MoTe₂ mass) and capacity retention of 80% over 100 cycles. Synchrotron‐based in situ X‐ray absorption near‐edge structures have revealed the unique lithium reaction pathway and storage mechanism, which is supported by density functional theory based calculations.     

Tent-Shaped Surface Morphologies of Silicon: Texturization by Metal Induced Etching

Silicon - Nano-metal/semiconductor junction dependent porosification of silicon has been studied here. The silicon nanostructures (SiNSs) have been textured on n- and p- type silicon wafers using...     

Locating the normal to relaxor phase boundary in Ba(Ti1−xHfx)O3 ceramics

In this article, we report our studies on the relaxor behavior of Ba(Ti_1−xHf_x)O₃ ceramics, made with close compositions between 0.20 ≤ x ≤ 0.30, to locate the hafnium concentration boundary for the normal to relaxor crossover. X-ray diffraction followed by Rietveld refinement shows the occurrence of single-phase cubic structure for the synthesized Ba(Ti_1−xHf_x)O₃ ceramics. Temperature and frequency dependence of the real (?′) and imaginary (?″) parts of the dielectric permittivity has been studied in the temperature range of 90-350 K at frequencies of 0.1, 1, 10, and 100 kHz. A diffuse phase transition accompanying frequency dispersion is observed in the permittivity versus temperature plots revealing the occurrence of relaxor ferroelectric behavior. The T_m verses Hf concentration plot shows a discontinuous jump and change in the slope at x = 0.23. Quantitative characterization based on phenomenological models has also been presented. The plausible mechanism of the relaxor behavior has been discussed. Substitution of Hf⁴⁺ for Ti⁴⁺ in BaTiO₃ reduces the long-range polar ordering yielding a diffuse ferroelectric phase transition.     

Investigation on gradient dielectric characteristics of bamboo (Dentroclamus strictus)

Dependence of dielectric constant (ε′) and dielectric dissipation factor (tan δ) on distance from outermost skin to the center of bamboo has been determined. Dielectric measurements have been done in the temperature range of 24–120°C and in the frequency range, 4–100 kHz. Gradient behavior in ε′ and tan δ has been found in bamboo. It has also been observed that ε′ and tan δ increase with increasing temperature and decrease with increasing frequency. Relaxation times have been calculated for the four samples at 80, 90, and 100°C temperatures, which show that relaxation time decreases with the increase of temperature because of the increased molecular mobility. A continuous increase in the hardness from center (48) to outer surface (70) and density from 0.45 to 0.80 g/cc has been observed. © 2006 Wiley Periodicals, Inc. J Appl Polym Sci 102: 380–386, 2006     

Phase Transformation and Optical Properties of Annealed Hydrothermally Synthesized ZnO/ZnCr2O4 Nanocomposites

The effect of postgrowth thermal annealing on ZnO/ZnCr₂O₄ nanocomposites synthesized by hydrothermal method has been thoroughly investigated. XRD data have clearly revealed the transformation of spinel cubic phase of ZnCr₂O₄ to wurtzite phase ZnO and indicated the incorporation of Cr in ZnO lattice with annealing at high temperatures. Photoluminescence spectra have shown a strong dependence of emission on annealing temperatures. This work demonstrated the unique and simple route to fabricate Cr‐doped ZnO and tuning of the luminescence with annealing temperature. Thus, the work has immense potential for optoelectronic and photovoltaic applications.     

Yield and soil nutrient balance of a sugarcane plant–ratoon system with conventional and organic nutrient management in sub-tropical India

A 3-year field trial of sugarcane, comprising 11 treatment combinations of different organic manures with and without Gluconacetobacter diazotrophicus (Gd), NPK and an absolute control, on an inceptisol was conducted to assess the effect of these treatments on sugarcane total and economic yield, the benefit:cost ratio, nutrient balance and soil quality in a sugarcane plant–ratoon system. The highest cane yield (78.6 t ha⁻¹) was recorded in the plant crop given vermicompost + Gd, whereas ratoon yields (first and second) were highest (80.8 and 74.9 t/ha⁻¹, respectively) with sulphitation press mud cake (SPMC) + Gd. In both plant and ratoon crops, a number of different organic manures produced the highest cane yield that was also statistically similar to those obtained with using the recommended NPK levels (76.1, 78.2 and 71.7 t/ha for plant crop and subsequent two ratoons, respectively). The highest benefit:cost (B:C) ratio in the plant and two ratoon crops (1.28, 2.36, 2.03 respectively) were obtained with the addition of SPMC + Gd. The nutrient balance for NPK in the soil was highest in the SPMC + Gd treatment. The highest increase in organic C (94%) and total N (87%), in comparison to the initial level, and soil microbial biomass C (113%) and soil microbial biomass N (229%), in comparison to the control treatment, was recorded with the addition of SPMC + Gd. The maximum decrease in soil bulk density (BD) (12%) with an increase in soil aggregate (17%) and water infiltration rate (35%) was obtained with the addition of SPMC. Overall, the sugarcane crop responded well to different organic manures in a multiple ratooning system with a better economic output and improved soil quality. Strategic planning in terms of an integrated application of these manures with inorganic chemicals will not only sustain our soils but will also be beneficial for our farmers in terms of reducing their dependence and expenditure on chemical fertilizers.     

Study of Porous Silicon Prepared Using Metal-Induced Etching (MIE): a Comparison with Laser-Induced Etching (LIE)

Porous silicon (p-Si), prepared by two routes (metal induced etching (MIE) and laser induced etching (LIE)) have been studied by comparing the observed surface morphologies using SEM. A uniformly distributed smaller (submicron sized) pores are formed when MIE technique is used because the pore formation is driven by uniformly distributed metal (silver in present case) nanoparticles, deposited prior to the porosification step. Whereas in p-Si, prepared by LIE technique, wider pores with some variation in pore size as compared to MIE technique is observed because a laser having gaussian profile of intensity is used for porosification. Uniformly distribute well-aligned Si nanowires are observed in samples prepared by MIE method as seen using cross-sectional SEM imaging. A single photoluminescence (PL) peak at 1.96 eV corresponding to red emission at room temperature is observed which reveals that the Si nanowires, present in p-Si prepared by MIE, show quantum confinement effect. The single PL peak confirms the presence of uniform sized nanowires in MIE samples. These vertically aligned Si nanowires can be used for field emission application.