Structures and Phase Transition of GaAs under Pressure

A first-principles plane wave method with the ultrasoft pseudopotential scheme in the frame of the density functional theory （DFT） is performed to calculate the lattice parameters a and c, the bulk modulus B0 and its pressure derivative B0 of the zinc-blende GaAs （ZB-GaAs）, rocksalt GaAs （RS-GaAs）, CsCl-GaAs, NiAs- GaAs and wurtzite GaAs （WZ-GaAs）. Our results are consistent with the available experimental data and other theoretical results. We also calculate the phase transition pressures among these different phases. The results are satisfactory.     

One electron atoms in both a squeezed vacuum and a magnetic field via path integral methods

In the present paper we study the dynamics of one-electron atoms in the presence of both a linearly polarized squeezed vacuum and a magnetic field along the polarization vector of the photonic field. We adopt the dipole approximation and approach the problem via path integral methods. After integrating over the light variables for certain initial and final squeezed vacuum states we treat the path integral over the spatial variables via Monte-Carlo methods. As an application we calculate the survival probability of the ground state of a one-electron atom for various values of the magnetic field. Received 30 November 2000 and Received in final form 15 February 2001     

Symmetry breaking and restoring under high pressure: the amazing behaviour of the “simple” alkali metals

We argue that an ionic lattice surrounded by a Fermi liquid changes phase several times under pressure, oscillating between the symmetric phase and a low-symmetry dimerized structure, as a consequence of Friedel oscillations in the pair potential. Phase oscillations explain the tendency towards dimerization which has been recently reported for the light alkali metals under high pressure. Moreover, a restoring of the symmetric phase is predicted for such elements at an even higher density. Received 17 January 2003 Published online 11 April 2003 RID="a" ID="a"e-mail: giuseppe.angilella@ct.infn.it     

Investigation of size-driven phase transition in bismuth titanate nanocrystals by Raman spectroscopy

Raman spectroscopy was used to investigate the lattice dynamics and structural transformations in bismuth titanate (Bi₄Ti₃O₁₂) nanocrystals prepared by a chemical coprecipitation technique. The crystal structure of the samples of different grain sizes was determined by X-ray-diffraction analysis. The evolution of the Raman spectrum with grain size was characterized by an intensity decrease, a broadening of the line width, a frequency shift, and the disappearance of the Raman mode. The results revealed the appearance of a size-driven phase transition from orthorhombic to tetragonal phases at a critical size of 44 nm. This result is quite consistent with the X-ray-diffraction measurement and differential thermal analysis. The origin was attributed to the grain-size effect and explained by the surface-energy mechanism. Received: 26 June 2002 / Accepted: 18 August 2002 / Published online: 15 January 2003 RID="*" ID="*"Corresponding author. Fax: +86-25/3595535, E-mail: msz@nju.edu.cn     

Combinatorial study of phase transformation characteristics of a Ti-Ni-Pd shape memory thin film composition spread in view of microactuator applications

Phase transformation characteristics of a Ti-Ni-Pd shape memory thin film composition spread have been investigated. The thin film composition spread was fabricated from elemental targets using an ultra-high vacuum combinatorial magnetron sputter-deposition system and subsequent annealing at 500 °C for 1 h in situ. Automated temperature-dependent resistance measurements (R(T)), energy dispersive X-ray analysis (EDX) and X-ray diffraction measurements (XRD) have been applied for the high-throughput characterization of the composition spread. Reversible phase transformations within the measurement range of −40 to 250 °C within the Ti-Ni-Pd system were observed for compositions with Ti content between 50 and ∼59 at.%. For Ti-richer films, Ti₂Ni and Ti₂Pd precipitates are inhibiting reversible phase transformations. The transformation temperatures and the thermal hysteresis were determined from R(T) measurements. Rising transformation temperatures with increasing Pd content and significantly lower thermal hysteresis for the B2-B19, compared to the B2-R-B19′ transformations were found in good agreement with published data. For low Pd contents (<7-12 at.%, depending on the Ti content) two-stage B2-R-B19′ transformations were observed. Compositions with higher Pd contents showed a single-stage B2-B19 transformation. Increasing Ti content within the B2-B19 transformation region results in a linear increase of the thermal hysteresis and decreasing transformation temperatures.     

Interaction of incoherent white-light solitons

We study numerically the formation and interactions of incoherent white-light solitons in a nonlinear media with logarithmic saturable nonlinearity based on the coherent density approach. We find that not only the formation but also the interactions of incoherent white-light solitons are fundamentally a collective effect, where all the frequencies participate in the process, and self-adjust their respective contributions to the formation and interactions. We find that the interactions of incoherent white-light solitons in logarithmic media are always attractive.     

Beam radiated from quasi-homogeneous uniformly polarized electromagnetic source scattering on quasi-homogeneous media

We study the coherence properties of the field generated by beam radiated from quasi-homogeneous (QH) electromagnetic source scattering on QH media. Formulas for the spectral density and spectral degree of coherence of the three dimensional scattered field are derived. The results show under assumption that the diagonal correlation coefficients of the source are proportional to each other, the far field of the scattered light satisfy two reciprocity relations analogous to that in the scalar case, that, the spectral density is proportional to the convolution of the spectral density of the source and the spatial Fourier transform of the correlation coefficient of the scattering potential; the spectral degree of coherence is proportional to the convolution of the diagonal correlation coefficients and the strength of the scattering potential.     

The Rhodes-Wohlfarth parameter as assessment of the displacive degree in ferroelectrics: The case of the Ф4> model

The Rhodes-Wohlfarth parameter extended to ferroelectrics by Tokunaga [J. Phys. Soc. Jap. 57, 4275 (1988)] is here analyzed within the model. It is shown that it can be directly related with the displacive degree of the transition as described by the ratio C / E ₀ , between the non-local coupling, C, driving the transition and the depth of the energy well, E₀, associated with the distorted structure. However, the Rhodes-Wohlfarth parameter becomes asymptotically constant as C / E ₀ decreases, i.e. for systems closer to the order disorder limit. Under this viewpoint, the very limited range of values observed for this experimental parameter is explained and is shown that, in general, it can only assess quantitatively the character of the transition in rather displacive cases. The argument can be generalized to more complex systems, and when applied to well known materials, a rough estimation of the displacive degree and the relevant microscopic energetic parameters in rather displacive ferroelectrics is possible. Received 23 December 1998 and Received in final form 4 May 1999     

Unified quantum mechanical picture for confined spinons in dimerized and frustrated spin chains

A quantum mechanical picture is presented to describe the behavior of confined spinons in a variety of S =1/2 chains. The confinement is due to dimerization and frustration and it manifests itself as a nonlinear potential , centered at chain ends () or produced by modulation kinks (b > 1). The calculation extends to weak or zero frustration some previous ideas valid for spinons in strongly frustrated spin chains. The local magnetization patterns of the confined spinons are calculated. A (minimum) enhancement of the local moments of about 11/3 over a single S =1/2 is found. Estimates for excitation energies and binding lengths are obtained. Received: 8 May 1998 / Revised and Accepted: 12 August 1998     

Interfacial roughness in a near-critical binary fluid mixture: X-ray reflectivity and near-specular diffuse scattering

Measurements are presented of the X-ray specular reflectivity and near-specular diffuse scattering of the interface in a near-critical mixture of hexane and perfluorohexane. A lineshape analysis of the scattered intensity at each temperature yields values for the interfacial tension and interfacial width. The temperature variation of the tension and width so-obtained are consistent with current understanding of this interface, which holds that there is, firstly, an intrinsic width over which the fluid density varies smoothly from one coexistence composition to the other, and, secondly, that the interface acquires an additional and larger statistical interfacial width as a result of capillary fluctuations. Received 1 April 1998