Brownian yet non-Gaussian diffusion in heterogeneous media: from superstatistics to homogenization

We discuss the situations under which Brownian yet non-Gaussian (BnG) diffusion can be observed in the model of a particle's motion in a random landscape of diffusion coefficients slowly varying in space. Our conclusion is that such behavior is extremely unlikely in the situations when the particles, introduced into the system at random at $t=0$, are observed from the preparation of the system on. However, it indeed may arise in the case when the diffusion (as described in Ito interpretation) is observed under equilibrated conditions. This paradigmatic situation can be translated into the model of the diffusion coefficient fluctuating in time along a trajectory, i.e. into a kind of the "diffusing diffusivity" model.Comment: 12 pages; 10 figure

Density functional simulation of small Fe nanoparticles

We calculate from first principles the electronic structure, relaxation and magnetic moments in small Fe particles, applying the numerical local orbitals method in combination with norm-conserving pseudopotentials. The accuracy of the method in describing elastic properties and magnetic phase diagrams is tested by comparing benchmark results for different phases of crystalline iron to those obtained by an all-electron method. Our calculations for the bipyramidal Fe_5 cluster qualitatively and quantitatively confirm previous plane-wave results that predicted a non-collinear magnetic structure. For larger bcc-related (Fe_35) and fcc-related (Fe_38, Fe_43, Fe_62) particles, a larger inward relaxation of outer shells has been found in all cases, accompanied by an increase of local magnetic moments on the surface to beyond 3 mu_B.Comment: 15 pages with 6 embedded postscript figures, updated version, submitted to Eur.Phys.J.

Linearized force constants method for lattice dynamics in mixed semiconductors

A simple and accurate method of calculating phonon spectra in mixed semiconductors alloys, on the basis of preliminarily (from first principles) relaxed atomic structure, is proposed and tested for (Zn,Be)Se and (Ga,In)As solid solutions. The method uses an observation that the interatomic force constants, calculated ab initio for a number of microscopic configurations in the systems cited, show a clear linear variation of the main (diagonal) values of the interatomic force constants with the corresponding bond length. We formulate simple rules about how to recover the individual 3x3 subblocks of the force constants matrix in their local (bonds-related) coordinate systems and how to transform them into a global (crystal cell-related) coordinate system. Test calculations done for 64-atom supercells representing different concentrations of (Zn,Be)Se and (Ga,In)As show that the phonon frequencies and compositions of eigenvectors are faithfully reproduced in a linearized force constants calculation, as compared to true ab initio calculations.Comment: to appear in the proceedings of the Phonons2007 conference (Paris, July 2007

Parametric Analysis of Cherenkov Light LDF from EAS for High Energy Gamma Rays and Nuclei: Ways of Practical Application

In this paper we propose a 'knee-like' approximation of the lateral distribution of the Cherenkov light from extensive air showers in the energy range 30-3000 TeV and study a possibility of its practical application in high energy ground-based gamma-ray astronomy experiments (in particular, in TAIGA-HiSCORE). The approximation has a very good accuracy for individual showers and can be easily simplified for practical application in the HiSCORE wide angle timing array in the condition of a limited number of triggered stations.Comment: 4 pages, 5 figures, proceedings of ISVHECRI 2016 (19th International Symposium on Very High Energy Cosmic Ray Interactions