12 research outputs found

    Which mechanism underlies the water-like anomalies in core-softened potentials?

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    Using molecular dynamics simulations we investigate the thermodynamic of particles interacting with a continuous and a discrete versions of a core-softened (CS) intermolecular potential composed by a repulsive shoulder. Dynamic and structural properties are also analyzed by the simulations. We show that in the continuous version of the CS potential the density at constant pressure has a maximum for a certain temperature. Similarly the diffusion constant, DD, at a constant temperature has a maximum at a density ρmax\rho_{\mathrm{max}} and a minimum at a density ρmin<ρmax\rho_{\mathrm{min}}<\rho_{\mathrm{max}}, and structural properties are also anomalous. For the discrete CS potential none of these anomalies are observed. The absence of anomalies in the discrete case and its presence in the continuous CS potential are discussed in the framework of the excess entropy.Comment: 8 page

    Studying Amphiphilic Self-assembly with Soft Coarse-Grained Models

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    STABILITY STUDIES OF HIGHLY RADIOACTIVE ALUMINA CALCINE DURING HIGH TEMPERATURE STORAGE

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    A Novel Instrument for Studying the Flow Behaviour of Erythrocytes through Microchannels Simulating Human

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    Original article can be found at: http://www.sciencedirect.com/science/journal/00262862 Copyright Elsevier Inc. DOI: 10.1006/mvre.1997.2014 [Full text of this article is not available in the UHRA]A novel instrument has been developed to study the microrheology of erythrocytes as they flow through channels of dimensions similar to human blood capillaries. The channels are produced in silicon substrates using microengineering technology. Accurately defined, physiological driving pressures and temperatures are employed whilst precise, real-time image processing allows individual cells to be monitored continuously during their transit. The instrument characterises each cell in a sample of ca. 1000 in terms of its volume and flow velocity profile during its transit through a channel. The unique representation of the data in volume/velocity space provides new insights into the microrheological behaviour of blood. The image processing and subsequent data analysis enable the system to reject anomalous events such as multiple cell transits, thereby ensuring integrity of the resulting data. By employing an array of microfluidic flow channels we can integrate a number of different but precise and highly reproducible channel sizes and geometries within one array, thereby allowing multiple, concurrent, isobaric measurements on one sample. As an illustration of the performance of the system, volume/velocity data sets recorded in a microfluidic device incorporating multiple channels of 100 μm length and individual widths ranging between 3.0 and 4.0 μm are presented.Peer reviewe

    Intraguild predation of the aphid pathogenic fungus Pandora neoaphidis by the invasive coccinellid Harmonia axyridis

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    1. The ladybird Harmonia axyridis is an invasive alien species in many countries and is predicted to have a negative impact on native biodiversity. However, little is known on the status of this aphidophage as an intraguild predator of natural enemies of aphids such as insect-pathogenic fungi. 2. The study assessed the predation of the aphid-specific pathogenic fungus Pandora neoaphidis by adult and larval H. axyridis collected from the U.K. (an invasive population) and Japan (a native population) relative to that of the ladybird Coccinella septempunctata (native to the U.K.) and the non-U.K. C. septempunctata subspecies brucki that were either starved or unstarved. 3. Overall, predation of uninfected aphids was greater than infected aphids and, when given a choice, a preference for aphids was shown. However, the extent of this preference was dependent on the species and origin of the coccinellid. Harmonia axyridis (U.K.) consumed the greatest quantity of fungal cadavers and showed little preference for uninfected aphids over infected aphids. In contrast, C. septempunctata rarely consumed infected aphids. Life stage had no direct effects on predation but starved coccinellids consumed more uninfected aphids than infected aphids. 4. Harmonia axyridis (U.K.) is a stronger intraguild predator of P. neoaphidis cadavers than the native species C. septempunctata and, therefore, may have an impact on the occurrence and persistence of P. neoaphidis . The differences in intraguild predation by H. axyridis collected in the U.K. and those from Japan suggests that individuals that invaded the U.K. could have a different genetic profile to those in its native range

    Critical-point and coexistence-curve properties of the Lennard-Jones fluid: A finite-size scaling study

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    Monte Carlo simulations within the grand canonical ensemble are used to explore the liquid-vapour coexistence curve and critical point properties of the Lennard-Jones fluid. Attention is focused on the joint distribution of density and energy fluctuations at coexistence. In the vicinity of the critical point, this distribution is analysed using mixed-field finite-size scaling techniques aided by histogram reweighting methods. The analysis yields highly accurate estimates of the critical point parameters, as well as exposing the size and character of corrections to scaling. In the sub-critical coexistence region the density distribution is obtained by combining multicanonical simulations with histogram reweighting techniques. It is demonstrated that this procedure permits an efficient and accurate mapping of the coexistence curve, even deep within the two phase region.Comment: 9 Pages Revtex. 8 encapsulated ps figures as separate uuencoded, gzipped tar file. To appear in Phys. Rev. E. Full paper also available from http://moses.physik.uni-mainz.de
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