Simulation of structure formation in disperse systems

The main rules governing the redistribution of microparticles in disperse systems were revealed by computer simulation. These rules predetermine the character and properties of the structure being formed, which opens up the possibility to control the properties of disperse materials, including sorbents and catalysts based on high-dispersity solid phases.     

Comment on breakup densities of hot nuclei

In [V.E. Viola et al., Phys. Rev. Lett. 93 (2004) 132701, D.S. Bracken et al., Phys. Rev. C 69 (2004) 034612] the observed decrease in spectral peak energies of IMFs emitted from hot nuclei was interpreted in terms of a breakup density that decreased with increasing excitation energy. Subsequently, Raduta et al. [Ad. Raduta et al., Phys. Lett. B 623 (2005) 43] performed MMM simulations that showed decreasing spectral peaks could be obtained at constant density. In this Letter we point out that this apparent inconsistency is due to a selective comparison of theory and data that overlooks the evolution of the fragment multiplicities as a function of excitation energy.     

Cathodoluminescence study of extended defects in hydrothermal ZnO crystals

Understanding the luminescence of ZnO is very important for some applications. In spite of the many studies carried out, there are still some points concerning the origin of some of the luminescence emissions in ZnO crystals that require additional study; in particular, the role of extended defects remains to be a matter of controversy. We present here a cathodoluminescence analysis of the defects generated by Vickers indentation in hydrothermal HTT crystals. Special emphasis was paid to the luminescence band peaking around 3.3 eV. The origin of this band is a matter of controversy, since it has been related to different causes, extended defects being one of the candidates for this emission. The CL images were acquired around crystal defects. It is observed that the 3.3 eV emission is enhanced around the crystal defects; though it is also observed, but weaker, out of the defect regions, which suggests that there exist two luminescence emissions peaking very close to 3.3 eV. The two emissions, one related to structural defects and the other to the LO phonon replica of the free excitonic band, appear very close each other and their relative intensity should determine the shape of the spectrum.     

Frozen Landweber Iteration for Nonlinear Ill-Posed Problems

In this paper we propose a modification of the Landweber iteration termed frozen Landweberiteration for nonlinear ill-posed problems.A convergence analysis for this iteration is presented.The numericalperformance of this frozen Landweber iteration for a nonlinear Hammerstein integral equation is compared withthat of the Landweber iteration.We obtain a shorter running time of the frozen Landweber iteration based onthe same convergence accuracy.     

An algebraic index theorem for orbifolds

Using the concept of a twisted trace density on a cyclic groupoid, a trace is constructed on a formal deformation quantization of a symplectic orbifold. An algebraic index theorem for orbifolds follows as a consequence of a local Riemann-Roch theorem for such densities. In the case of a reduced orbifold, this proves a conjecture by Fedosov, Schulze, and Tarkhanov. Finally, it is shown how the Kawasaki index theorem for elliptic operators on orbifolds follows from this algebraic index theorem.     

Cauchy-Born Rule and the Stability of Crystalline Solids： Dynamic Problems

We study continuum and atomistic models for the elastodynamics of crystalline solids at zerotemperature.We establish sharp criterion for the regime of validity of the nonlinear elastic wave equationsderived from the well-known Cauchy-Born rule.     

Parallelization of population-based multi-objective meta-heuristics: An empirical study

In single-objective optimization it is possible to find a global optimum, while in the multi-objective case no optimal solution is clearly defined, but several that simultaneously optimize all the objectives. However, the majority of this kind of problems cannot be solved exactly as they have very large and highly complex search spaces. Recently, meta-heuristic approaches have become important tools for solving multi-objective problems encountered in industry as well as in the theoretical field. Most of these meta-heuristics use a population of solutions, and hence the runtime increases when the population size grows. An interesting way to overcome this problem is to apply parallel processing. This paper analyzes the performance of several parallel paradigms in the context of population-based multi-objective meta-heuristics. In particular, we evaluate four alternative parallelizations of the Pareto simulated annealing algorithm, in terms of quality of the solutions, and speedup.     

Photoemission studies of oxygen adsorbed on a LiAl(1 1 0) alloy surface: Role of Li segregation

We investigated that the effect of the number of segregated Li atoms on the rate of oxidation on a LiAl alloy surface. Oxygen molecules adsorbed on the LiAl alloy react with the surface atoms to form stable oxides. The segregated Li atoms at reconstructed surfaces (c(2×2) and (2×1)) enhance the oxidation rate and form stable LiAlO_x and Li₂O. The degree of enhancement of oxidation by segregated Li atoms varies as a function of O₂ exposure and annealing temperature, where the latter is directly related to the mode of surface reconstruction by Li segregation.     

Exact and approximate results for the Anderson impurity model

This paper provides exact and rigorous upper and lower bounds to the ground state energy of the Single Impurity Anderson Model in the limit of infiniteU. The upper bound approximates the ground state energy very well and the corresponding state may be used as a starting point for further investigations. The energy spectrum of the Single Impurity Anderson Model is calculated exactly for a special non-trivial model density of states describing the bare band electrons. All approaches introduced here are compared to this exact result and to other ground state energy calculations.