Tailoring the Phonon Band Structure in Binary Colloidal Mixtures

We analyze the phonon spectra of periodic structures formed by two-dimensional mixtures of dipolar colloidal particles. These mixtures display an enormous variety of complex ordered configurations [J. Fornleitner {\it et al.}, Soft Matter {\bf 4}, 480 (2008)], allowing for the systematic investigation of the ensuing phonon spectra and the control of phononic gaps. We show how the shape of the phonon bands and the number and width of the phonon gaps can be controlled by changing the susceptibility ratio, the concentration and the mass ratio between the two components.Comment: 4 pages 3 figure

Spin correlation functions in random-exchange s=1/2 XXZ chains

The decay of (disorder-averaged) static spin correlation functions at T=0 for the one-dimensional spin-1/2 XXZ antiferromagnet with uniform longitudinal coupling $J\Delta$ and random transverse coupling $J\lambda_i$ is investigated by numerical calculations for ensembles of finite chains. At $\Delta=0$ (XX model) the calculation is based on the Jordan-Wigner mapping to free lattice fermions for chains with up to N=100 sites. At $\Delta \neq 0$ Lanczos diagonalizations are carried out for chains with up to N=22 sites. The longitudinal correlation function is found to exhibit a power-law decay with an exponent that varies with $\Delta$ and, for nonzero $\Delta$, also with the width of the $\lambda_i$-distribution. The results for the transverse correlation function show a crossover from power-law decay to exponential decay as the exchange disorder is turned on.Comment: RevTex manuscript (7 pages), 4 postscript figure

Zero temperature phase diagram of the square-shoulder system

Particles that interact via a square-shoulder potential, consisting of an impenetrable hard core with an adjacent, repulsive, step-like corona, are able to self-organize in a surprisingly rich variety of rather unconventional ordered structures. Using optimization strategies that are based on ideas of genetic algorithms we encounter, as we systematically increase the pressure, the following archetypes of aggregates: low-symmetry cluster and columnar phases, followed by lamellar particle arrangements, until at high pressure values compact, high-symmetry lattices emerge. These structures are characterized in the NPT ensemble as configurations of minimum Gibbs free energy. Based on simple considerations, i.e., basically minimizing the number of overlapping coronae while maximizing at the same time the density, the sequence of emerging structures can easily be understood.Comment: Submitted to J. Chem. Phy

Formation of Polymorphic Cluster Phases for Purely Repulsive Soft Spheres

We present results from density functional theory and computer simulations that unambiguously predict the occurrence of first-order freezing transitions for a large class of ultrasoft model systems into cluster crystals. The clusters consist of fully overlapping particles and arise without the existence of attractive forces. The number of particles participating in a cluster scales linearly with density, therefore the crystals feature density-independent lattice constants. Clustering is accompanied by polymorphic bcc-fcc transitions, with fcc being the stable phase at high densities.Comment: 4 pages, 5 figures, submitted to Phys. Rev. Let

Testing a simple recipe for estimating galaxy masses from minimal observational data

The accuracy and robustness of a simple method to estimate the total mass profile of a galaxy is tested using a sample of 65 cosmological zoom-simulations of individual galaxies. The method only requires information on the optical surface brightness and the projected velocity dispersion profiles and therefore can be applied even in case of poor observational data. In the simulated sample massive galaxies ($\sigma \simeq 200-400$ \kms) at redshift $z=0$ have almost isothermal rotation curves for broad range of radii (RMS $\simeq 5$ for the circular speed deviations from a constant value over $0.5R_{\rm eff} < r < 3R_{\rm eff}$). For such galaxies the method recovers the unbiased value of the circular speed. The sample averaged deviation from the true circular speed is less than $\sim 1$ with the scatter of $\simeq 5-8$ (RMS) up to $R \simeq 5R_{\rm eff}$. Circular speed estimates of massive non-rotating simulated galaxies at higher redshifts ($z=1$ and $z=2$) are also almost unbiased and with the same scatter. For the least massive galaxies in the sample ($\sigma < 150$ \kms) at $z=0$ the RMS deviation is $\simeq 7-9$ and the mean deviation is biased low by about $1-2$. We also derive the circular velocity profile from the hydrostatic equilibrium (HE) equation for hot gas in the simulated galaxies. The accuracy of this estimate is about RMS $\simeq 4-5$ for massive objects ($M > 6.5\times 10^{12} M_\odot$) and the HE estimate is biased low by $\simeq 3-4$, which can be traced to the presence of gas motions. This implies that the simple mass estimate can be used to determine the mass of observed massive elliptical galaxies to an accuracy of $5-8$ and can be very useful for galaxy surveys.Comment: 15 pages, 14 figures, 1 tabl

The Two-Dimensional, Rectangular, Guillotineable-Layout Cutting Problem with a Single Defect

In this paper, a two-dimensional cutting problem is considered in which a single plate (large object) has to be cut down into a set of small items of maximal value. As opposed to standard cutting problems, the large object contains a defect, which must not be covered by a small item. The problem is represented by means of an AND/OR-graph, and a Branch & Bound procedure (including heuristic modifications for speeding up the search process) is introduced for its exact solution. The proposed method is evaluated in a series of numerical experiments that are run on problem instances taken from the literature, as well as on randomly generated instances.Two-dimensional cutting, defect, AND/OR-graph, Branch & Bound

Computer Assembly of Cluster-Forming Amphiphilic Dendrimers

Recent theoretical studies have predicted a new clustering mechanism for soft matter particles that interact via a certain kind of purely repulsive, bounded potentials. At sufficiently high densities, clusters of overlapping particles are formed in the fluid, which upon further compression crystallize into cubic lattices with density-independent lattice constants. In this work we show that amphiphilic dendrimers are suitable colloids for the experimental realization of this phenomenon. Thereby, we pave the way for the synthesis of such macromolecules, which form the basis for a novel class of materials with unusual properties.Comment: 4 pages, 4 figures, 1 tabl