564 research outputs found

    Gauge Five Brane Dynamics And Small Instanton Transitions In Heterotic Models

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    We present the first examples of cosmological solutions to four-dimensional heterotic models which include an evolving bundle modulus. The particular bundle modulus we consider corresponds to the width of a gauge five brane. As such our solutions can be used to describe the evolution in one of these models after a small instanton transition. We find that certain properties are generic to these solutions, regardless of initial conditions. This enables us to make some definite statements about the dynamics subsequent to a small instanton transition despite the fact that we cannot microscopically describe the process itself. We also show that an effective description of the small instanton transition by a continuous matching of fields and their first derivatives is precluded by the form of the respective low-energy theories before and after the transition.Comment: 16 pages, 3 figure

    Quantitative LEED I-V and ab initio study of the Si(111)-3x2-Sm surface structure and the missing half order spots in the 3x1 diffraction pattern

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    We have used Low Energy Electron Diffraction (LEED) I-V analysis and ab initio calculations to quantitatively determine the honeycomb chain model structure for the Si(111)-3x2-Sm surface. This structure and a similar 3x1 recontruction have been observed for many Alkali-Earth and Rare-Earth metals on the Si(111) surface. Our ab initio calculations show that there are two almost degenerate sites for the Sm atom in the unit cell and the LEED I-V analysis reveals that an admixture of the two in a ratio that slightly favours the site with the lower energy is the best match to experiment. We show that the I-V curves are insensitive to the presence of the Sm atom and that this results in a very low intensity for the half order spots which might explain the appearance of a 3x1 LEED pattern produced by all of the structures with a 3x2 unit cell.Comment: 10 pages, 13 figures. Preliminary work presented at the the APS March meeting, Baltimore MD, 2006. To be published in Phys. Rev. B. April/May 200

    Improved real-space genetic algorithm for crystal structure and polymorph prediction

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    Existing genetic algorithms for crystal structure and polymorph prediction can suffer from stagnation during evolution, with a consequent loss of efficiency and accuracy. An improved genetic algorithm is introduced herein which penalizes similar structures and so enhances structural diversity in the population at each generation. This is shown to improve the quality of results found for the theoretical prediction of simple model crystal structures. In particular, this method is demonstrated to find three new zero-temperature phases of the Dzugutov potential that have not been previously reported

    STM and ab initio study of holmium nanowires on a Ge(111) Surface

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    A nanorod structure has been observed on the Ho/Ge(111) surface using scanning tunneling microscopy (STM). The rods do not require patterning of the surface or defects such as step edges in order to grow as is the case for nanorods on Si(111). At low holmium coverage the nanorods exist as isolated nanostructures while at high coverage they form a periodic 5x1 structure. We propose a structural model for the 5x1 unit cell and show using an ab initio calculation that the STM profile of our model structure compares favorably to that obtained experimentally for both filled and empty states sampling. The calculated local density of states shows that the nanorod is metallic in character.Comment: 4 pages, 12 figures (inc. subfigures). Presented at the the APS March meeting, Baltimore MD, 200

    Aquatic virus culture collection: an absent (but necessary) safety net for environmental microbiologists

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    Viruses are recognised as the most abundant biological entities on the planet. In addition to their role in disease, they are crucial components of co-evolutionary processes, are instrumental in global biogeochemical pathways such as carbon fluxes and nutrient recycling, and in some cases act regionally on climate processes. Importantly, viruses harbour an enormous, as of yet unexplored genetic and metabolic potential. Some viruses infecting microalgae harbour hundreds of genes, including genes involved in cellular metabolic pathways. Collectively, these attributes have given rise to new fields of research: environmental virology and viral ecology. While traditionally the potential of viruses was recognised by isolating novel viruses into culture and subsequent sequencing of their genomes in the laboratory, advancements in next-generation sequencing technologies now allow for direct sequencing of viral genomes from their natural setting, bypassing the need for culturing. Nevertheless, the lack of associated biological reference material with most of these novel environmental genomes is problematic as there are limitations to what can be achieved with sequence data alone. Where aquatic viruses do exist in culture, they are most often kept privately within research institutes and are not available to the wider research community. Many are thus at risk of being lost because research teams rarely have secure long term resources to ensure continued propagation. Culture collections do exist for medically and agriculturally important viruses causing disease, but collections focusing on viruses infecting aquatic algae and bacteria are non-existent. We therefore highlight here the need for a centralised depository for aquatic viruses and present arguments indicating the benefits such a collection would have for the scientific community of environmental virologists

    Atomistic Molecular Dynamics Simulations of Shock Compressed Quartz

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    Atomistic non-equilibrium molecular dynamics (NEMD) simulations of shock wave compression of quartz have been performed using the so-called BKS semi-empirical potential of van Beest, Kramer and van Santen to construct the Hugoniot of quartz. Our scheme mimics the real world experimental set up by using a flyer-plate impactor to initiate the shock wave and is the first shock wave simulation that uses a geom- etry optimised system of a polar slab in a 3-dimensional system employing periodic boundary conditions. Our scheme also includes the relaxation of the surface dipole in the polar quartz slab which is an essential pre-requisite to a stable simulation. The original BKS potential is unsuited to shock wave calculations and so we propose a simple modification. With this modification, we find that our calculated Hugoniot is in good agreement with experimental shock wave data up to 25 GPa, but significantly diverges beyond this point. We conclude that our modified BKS potential is suitable for quartz under representative pressure conditions of the Earth core, but unsuitable for high-pressure shock wave simulations. We also find that the BKS potential incorrectly prefers the {\beta}-quartz phase over the {\alpha}-quartz phase at zero-temperature, and that there is a {\beta} \rightarrow {\alpha} phase-transition at 6 GPa.Comment: 19 pages, 13 figures, Accepted for publication in Journal of Chemical Physic

    High temperature decreases the PIC / POC ratio and increases phosphorus requirements in <i>Coccolithus pelagicus</i> (Haptophyta)

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    Rising ocean temperatures will likely increase stratification of the water column and reduce nutrient input into the photic zone. This will increase the likelihood of nutrient limitation in marine microalgae, leading to changes in the abundance and composition of phytoplankton communities, which in turn will affect global biogeochemical cycles. Calcifying algae, such as coccolithophores, influence the carbon cycle by fixing CO<sub>2</sub> into particulate organic carbon through photosynthesis (POC production) and into particulate inorganic carbon through calcification (PIC production). As calcification produces a net release of CO<sub>2</sub>, the ratio of PIC to POC production determines whether coccolithophores act as a source (high PIC / POC) or a sink (low PIC / POC) of atmospheric CO<sub>2</sub>. We studied the effect of phosphorus (P-) limitation and high temperature on the physiology and the PIC / POC ratio of two subspecies of Coccolithus pelagicus. This large and heavily calcified species is a major contributor to calcite export from the photic zone into deep-sea reservoirs. Phosphorus limitation did not influence exponential growth rates in either subspecies, but P-limited cells had significantly lower cellular P-content. One of the subspecies was subjected to a 5 °C temperature increase from 10 °C to 15 °C, which did not affect exponential growth rates either, but nearly doubled cellular P-content under both high and low phosphate availability. This temperature increase reduced the PIC / POC ratio by 40–60%, whereas the PIC / POC ratio did not differ between P-limited and nutrient-replete cultures when the subspecies were grown near their respective isolation temperature. Both P-limitation and elevated temperature significantly increased coccolith malformations. Our results suggest that a temperature increase may intensify P-limitation due to a higher P-requirement to maintain growth and POC production rates, possibly reducing abundances in a warmer ocean. Under such a scenario <i>C. pelagicus</i> may decrease its calcification rate relative to photosynthesis, thus favouring CO<sub>2</sub> sequestration over release. It seems unlikely that P-limitation by itself causes changes in the PIC / POC ratio in this species
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