Structural Basis for the Anomalously Low Spontaneous Polarisation Values of the Polar Phase of Sr1-xCaxTiO3 (x=0.02, 0.04): Evidence for a Ferrielectric Ordering

Full pattern Le-Bail refinement using x-ray powder diffraction profiles of Sr1-xCaxTiO3 for x=0.02, 0.04 in the temperature range 12 to 300 K reveals anomalies in the unit cell parameters at 170, 225 K due to an antiferrodistortive (cubic to tetragonal I4/mcm) phase transition and at ~32, ~34 K due to a transition to a polar phase (tetragonal I4/mcm to orthorhombic Ic2m), respectively. The lower transition temperatures obtained by us are in excellent agreement with those reported on the basis of the dielectric studies by Bednorz and Muller, [10] who attributed these to ferroelectric transition. Rietveld analysis of the diffraction profiles of the polar phase reveals off-centre displacements of both Sr2+/Ca2+ and Ti4+ ions in the X-Y plane along pseudocubic directions, in agreement with the experimentally reported direction of easy polarization by Bednorz and Muller, but the resulting dipole moments are shown to be ferrielectrically coupled in the neighbouring (001) planes along the [001] direction leading to anomalously low values of the spontaneous polarization at 12K.Comment: 5 pages, 4 figures and 1 tabl

Disorder-induced critical exponents near a ferromagnetic quantum critical point in Mn1−xCrxSi

We report the observation of critical behavior in Mn1−xCrxSi (0≤x≤1) close to a T = 0 K quantum critical point, consistent with the Belitz-Kirkpatrick-Vojta (BKV) theory of disordered metallic ferromagnets. The critical exponents are in good agreement with the theoretical predictions of the BKV theory in the preasymptotic limit. A non-Fermi liquid-like behavior is seen down to 200 mK in the transport and thermodynamic properties around the critical concentration xC = 0.2. Quantum criticality and self-consistency of the exponents is further confirmed using a scaling analysis of the magnetization and heat capacity data. A recovery to Fermi liquid-like behavior is displayed on moving away from the critical composition, as well as with the application of a magnetic field

On the rupture of DNA molecule

Using Langevin Dynamic simulations, we study effects of the shear force on the rupture of a double stranded DNA molecule. The model studied here contains two single diblock copolymers interacting with each other. The elastic constants of individual segments of the diblock copolymer are considered to be different. We showed that the magnitude of the rupture force depends on whether the force is applied at $3'-3'-$ends or $5'-5'-$ends. Distributions of extension in hydrogen bonds and covalent bonds along the chain show the striking differences. Motivated by recent experiments, we have also calculated the variation of rupture force for different chain lengths. Results obtained from simulations have been validated with the analytical calculation based on the ladder model of DNA.Comment: 7 pages and 4 figure

Stretching of a single-stranded DNA: Evidence for structural transition

Recent experiments have shown that the force-extension (F-x) curve for single-stranded DNA (ssDNA) consisting only of adenine [poly(dA)] is significantly different from thymine [poly(dT)]. Here, we show that the base stacking interaction is not sufficient to describe the F-x curves as seen in the experiments. A reduction in the reaction co-ordinate arising from the formation of helix at low forces and an increase in the distance between consecutive phosphates of unstacked bases in the stretched state at high force in the proposed model, qualitatively reproduces the experimentally observed features. The multi-step plateau in the F-x curve is a signature of structural change in ssDNA.Comment: 10 pages, 4 figure

Interplay between Phonon Confinement and Fano Effect on Raman line shape for semiconductor nanostructures: Analytical study

Theoretical Raman line shape functions have been studied to take care of quantum confinement effect and Fano effect individually and jointly. The characteristics of various Raman line shapes have been studied in terms of the broadening and asymmetry of Raman line shapes. It is shown that the asymmetry in the Raman line-shape function caused by these two effects individually does not add linearly to give asymmetry of line-shape generated by considering the combined effect. This indicates existence of interplay between the two effects. The origin of interplay lies in the fact that Fano effect itself depends on quantum confinement effect and in turn provides an asymmetry. This can not be explained by considering the two effects contribution independent of each other.Comment: 10 Page

Role of Metal Nanoparticles on porosification of silicon by metal induced etching (MIE)

Porosification of silicon (Si) by metal induced etching (MIE) process have been studies here to understand the etching mechanism. The etching mechanism has been discussed on the basis of electron transfer from Si to metal ion (Ag$^+$) and metal to H$_2$O$_2$. Role of silver nanoparticles (AgNPs) in the etching process has been investigated by studying the effect of AgNPs coverage on surface porosity. A quantitative analysis of SEM images, done using Image J, shows a direct correlation between AgNPs coverage and surface porosity after the porosification. Density of Si nanowires (NWs) also varies as a function of AgNPs fractional coverage which reasserts the fact that AgNPs governs the porosification process during MIE.Comment: 8 pages, 5 figure

Thermal effects on electron-phonon interaction in silicon nanostructures

Raman spectra from silicon nanostructures, recorded using excitation laser power density of 1.0 kW/cm^2, is employed here to reveal the dominance of thermal effects at temperatures higher than the room temperature. Room temperature Raman spectrum shows only phonon confinement and Fano effects. Raman spectra recorded at higher temperatures show increase in FWHM and decrease in asymmetry ratio with respect to its room temperature counterpart. Experimental Raman scattering data are analyzed successfully using theoretical Raman line-shape generated by incorporating the temperature dependence of phonon dispersion relation. Experimental and theoretical temperature dependent Raman spectra are in good agreement. Although quantum confinement and Fano effects persists, heating effects start dominating at higher temperatures than room tempaerature.Comment: 9 Pages, 3 Figures and 1 Tabl