6,330 research outputs found

    Snell's Law for a vortex dipole in a Bose-Einstein condensate

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    A quantum vortex dipole, comprised of a closely bound pair of vortices of equal strength with opposite circulation, is a spatially localized travelling excitation of a planar superfluid that carries linear momentum, suggesting a possible analogy with ray optics. We investigate numerically and analytically the motion of a quantum vortex dipole incident upon a step-change in the background superfluid density of an otherwise uniform two-dimensional Bose-Einstein condensate. Due to the conservation of fluid momentum and energy, the incident and refracted angles of the dipole satisfy a relation analogous to Snell's law, when crossing the interface between regions of different density. The predictions of the analogue Snell's law relation are confirmed for a wide range of incident angles by systematic numerical simulations of the Gross-Piteavskii equation. Near the critical angle for total internal reflection, we identify a regime of anomalous Snell's law behaviour where the finite size of the dipole causes transient capture by the interface. Remarkably, despite the extra complexity of the surface interaction, the incoming and outgoing dipole paths obey Snell's law.Comment: 16 pages, 7 figures, Scipost forma

    Three-body interactions in complex fluids: virial coefficients from simulation finite-size effects

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    A simulation technique is described for quantifying the contribution of three-body interactions to the thermodynamical properties of coarse-grained representations of complex fluids. The method is based on comparing the third virial coefficient B3B_3 for a complex fluid with that of an approximate coarse-grained model described by a pair potential. To obtain B3B_3 we introduce a new technique which expresses its value in terms of the measured volume-dependent asymptote of a certain structural function. The strategy is applicable to both Molecular Dynamics and Monte Carlo simulation. Its utility is illustrated via measurements of three-body effects in models of star polymer and highly size-asymmetrical colloid-polymer mixtures.Comment: 13 pages, 8 figure

    Storage stability of whole and nibbed, conventional and high oleic peanuts (<i>Arachis hypogeae </i>L.)

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    Peanuts are increasingly being used as nibbed ingredients in cereal bars, confectionery and breakfast cereals. However, studies on their oxidative stability in this format are limited. Storage trials to determine the stability to oxidation were carried out on whole and nibbed kernels of conventional (CP) and high oleic (HOP) peanuts, with respect to temperature and modified atmosphere packaging. HOP exhibited the highest oxidative stability, with a lag phase in whole kernels of 12–15 weeks before significant oxidation occurred. HOP also showed higher levels of intrinsic antioxidants, a trolox equivalent antioxidant capacity (TEAC) of 70 mMol equivalence and radical scavenging percentage (RSP) of 99.8 % at the beginning of storage trials, whereas CP showed values of 40 mMol and 81.2 %, respectively. The intrinsic antioxidants at the beginning of these storage trials were shown to affect the peroxide value (PV), where RSP and TEAC decreased, and PV increased. Therefore, in peanuts the processing format (nibbed or whole) had the highest influence on susceptibility of lipid oxidation, highest to lowest importance: processing format &gt; temperature &gt; atmospheric conditions

    Identifying Heating Technologies suitable for Historic Churches, Taking into Account Heating Strategy and Conservation through Pairwise Analysis

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    As a result of difficulty meeting energy efficiency through fabric alteration, historic churches must focus on heating systems and operational strategy as key to reducing carbon emissions. Strategies can be defined as local or central heating. Local heating strives to heat occupants, while central heating aims to heat the building fabric and therefore the occupants. Each strategy requires a different approach to control and technology in response to priorities such as conservation, comfort and cost. This paper reviews current and emerging technologies in the context of church heating. The fuel source, heat generation technology and heat emitter are arranged in a matrix, with pairwise analysis undertaken to create weightings for each assessment criteria. The process of constructing the matrix and undertaking pairwise analysis using personas is discussed. The result is a ranking of fuels and technologies appropriate to the main priorities and individual preferences. Some desirable technologies are inherently more damaging to historic church environments due to invasive installation. These technologies score poorly when the aim is fabric preservation. Greener fuels, like biomass, may rank lower than fossil fuels, due in part to operational differences

    Identification of diverse database subsets using property-based and fragment-based molecular descriptions

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    This paper reports a comparison of calculated molecular properties and of 2D fragment bit-strings when used for the selection of structurally diverse subsets of a file of 44295 compounds. MaxMin dissimilarity-based selection and k-means cluster-based selection are used to select subsets containing between 1% and 20% of the file. Investigation of the numbers of bioactive molecules in the selected subsets suggest: that the MaxMin subsets are noticeably superior to the k-means subsets; that the property-based descriptors are marginally superior to the fragment-based descriptors; and that both approaches are noticeably superior to random selection

    Monte Carlo cluster algorithm for fluid phase transitions in highly size-asymmetrical binary mixtures

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    Highly size-asymmetrical fluid mixtures arise in a variety of physical contexts, notably in suspensions of colloidal particles to which much smaller particles have been added in the form of polymers or nanoparticles. Conventional schemes for simulating models of such systems are hamstrung by the difficulty of relaxing the large species in the presence of the small one. Here we describe how the rejection-free geometrical cluster algorithm (GCA) of Liu and Luijten [Phys. Rev. Lett 92, 035504 (2004)] can be embedded within a restricted Gibbs ensemble to facilitate efficient and accurate studies of fluid phase behavior of highly size-asymmetrical mixtures. After providing a detailed description of the algorithm, we summarize the bespoke analysis techniques of Ashton et al. [J. Chem. Phys. 132, 074111 (2010)] that permit accurate estimates of coexisting densities and critical-point parameters. We apply our methods to study the liquid--vapor phase diagram of a particular mixture of Lennard-Jones particles having a 10:1 size ratio. As the reservoir volume fraction of small particles is increased in the range 0--5%, the critical temperature decreases by approximately 50%, while the critical density drops by some 30%. These trends imply that in our system, adding small particles decreases the net attraction between large particles, a situation that contrasts with hard-sphere mixtures where an attractive depletion force occurs.Comment: 11 pages, 10 figure

    Multistability of free spontaneously-curved anisotropic strips

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    Multistable structures are objects with more than one stable conformation, exemplified by the simple switch. Continuum versions are often elastic composite plates or shells, such as the common measuring tape or the slap bracelet, both of which exhibit two stable configurations: rolled and unrolled. Here we consider the energy landscape of a general class of multistable anisotropic strips with spontaneous Gaussian curvature. We show that while strips with non-zero Gaussian curvature can be bistable, strips with positive spontaneous curvature are always bistable, independent of the elastic moduli, strips of spontaneous negative curvature are bistable only in the presence of spontaneous twist and when certain conditions on the relative stiffness of the strip in tension and shear are satisfied. Furthermore, anisotropic strips can become tristable when their bending rigidity is small. Our study complements and extends the theory of multistability in anisotropic shells and suggests new design criteria for these structures.Comment: 20 pages, 10 figure

    Enantiospecific antitrypanosomal in vitro activity of eflornithine

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    The polyamine synthesis inhibitor eflornithine is a recommended treatment for the neglected tropical disease Gambian human African trypanosomiasis in late stage. This parasitic disease, transmitted by the tsetse fly, is lethal unless treated. Eflornithine is administered by repeated intravenous infusions as a racemic mixture of L-eflornithine and D-eflornithine. The study compared the in vitro antitrypanosomal activity of the two enantiomers with the racemic mixture against three Trypanosoma brucei gambiense strains. Antitrypanosomal in vitro activity at varying drug concentrations was analysed by non-linear mixed effects modelling. For all three strains, L-eflornithine was more potent than D-eflornithine. Estimated 50% inhibitory concentrations of the three strains combined were 9.1 muM (95% confidence interval [8.1; 10]), 5.5 muM [4.5; 6.6], and 50 muM [42; 57] for racemic eflornithine, L-eflornithine and D-eflornithine, respectively. The higher in vitro potency of L-eflornithine warrants further studies to assess its potential for improving the treatment of late-stage Gambian human African trypanosomiasis
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