1,916 research outputs found

    Molecular Realism in Default Models for Information Theories of Hydrophobic Effects

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    This letter considers several physical arguments about contributions to hydrophobic hydration of inert gases, constructs default models to test them within information theories, and gives information theory predictions using those default models with moment information drawn from simulation of liquid water. Tested physical features include: packing or steric effects, the role of attractive forces that lower the solvent pressure, and the roughly tetrahedral coordination of water molecules in liquid water. Packing effects (hard sphere default model) and packing effects plus attractive forces (Lennard-Jones default model) are ineffective in improving the prediction of hydrophobic hydration free energies of inert gases over the previously used Gibbs and flat default models. However, a conceptually simple cluster Poisson model that incorporates tetrahedral coordination structure in the default model is one of the better performers for these predictions. These results provide a partial rationalization of the remarkable performance of the flat default model with two moments in previous applications. The cluster Poisson default model thus will be the subject of further refinement.Comment: 5 pages including 3 figure

    Precambrian mineralising events in central West Greenland (66°–70°15´N)

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    During the past decade the Geological Survey of Denmark and Greenland (GEUS) has carried out two major resource evaluations in the Precambrian basement terranes of South and West Greenland in order to locate potential areas of mineral deposits (Steenfelt et al. 2000, 2004; Stendal & Schønwandt 2003; Stendal et al. 2004). Based on geological field work and geochemical and geophysical data, these evaluations have assessed the interplay between the magmatic, tectonic and metamorphic evolution in the study areas and their mineralising events. As a result of the second of these evaluations it is now possible to outline a succession of mineralising events in the northern part of the Nagssugtoqidian orogen and in the Disko Bugt area of central West Greenland (Fig. 1), and relate them to the general Archaean and Palaeoproterozoic geological evolution of this region. However, uncertainties still exist concerning the age and detailed setting of many epigenetic mineralisations
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