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Stephan Lowitzer Dan J. Wilson Björn Winkler Victor Milman Julian D. Gale 《Physics and Chemistry of Minerals》2008,35(3):129-135
Knowledge of the defect properties of Lunar and Mercurian minerals has recently become important, with the advent of models
which attempt to explain the formation of the thin exosphere of these celestial bodies. Here, we have calculated the formation
energies of sodium and oxygen vacancies in the mineral albite (NaAlSi3O8), as well as the Schottky defect energy for the removal of a Na2O unit. We have employed both the supercell and Mott–Littleton approaches, using Kohn–Sham density functional theory and classical
interatomic potential methods. As well as reporting the defect energies and structures, we comment upon the relative merits
of the methods used. 相似文献
3.
Aldo Chircop 《Ocean & Coastal Management》1996,31(2-3)
The author surveys some of the principal amendments to the Barcelona system adopted at the Ninth Ordinary Meeting of Contracting Parties to the Barcelona Convention in June 1995 and underlines the new national responsibilities for the implementation of the policy, legal and institutional changes in the direction of sustainable development. Emphasis is placed on the types of human resources that will be needed to facilitate implementation and render the regime effective at both national and regional levels. The author advocates a role for Mediterranean universities to assist regional regime-building through the development of relevant marine affairs education programmes in support of the Mediterranean Action Plan (MAP). A catalytic role for the United Nations Environment Programme (UNEP)/MAP Coordinating Unit in mobilizing inter-university cooperation is also identified. 相似文献
4.
R. M. Kippen J. Ryan A. Connors M. McConnell C. Winkler L. O. Hanlon V. Schönfelder J. Greiner M. Varendorff W. Collmar W. Hermsen L. Kuiper 《Astrophysics and Space Science》1995,231(1-2):231-234
In its first three years of operation, the COMPTEL instrument on theCompton Gamma-Ray Observatory has measured the locations (mean accuracy 1°) and spectra (0.75-30 MeV) of 18 gamma-ray bursts and continues to observe new events at a rate of 1/month. With good angular resolution and sensitivity at MeV energies, the growing COMPTEL burst catalog is an important new piece of evidence in the on-going GRB mystery. The COMPTEL burst locations are consistent with an isotropic distribution of sources, yet the spatial coincidence of two of the bursts indicates the possibility of repetition. The COMPTEL burst spectra are in most cases consistent with a single power law model with spectral index in the range 2–3. However, two bursts show evidence of a spectral break in the MeV range. Measurement of rapid variability at MeV energies in the stronger bursts provides evidence that either the sources are nearby (within the Galaxy) or the gamma-ray emission is relativistically beamed. We present an overview of analysis results obtained from the COMPTEL burst catalog concentrating on the search for burst repetition and the implications of highly variable MeV emission. 相似文献
5.
The Swiss Prealpine Dranse nappe consists of the badly known shaley Complexe de base series and the overlying Campanian to Maastrichtian Helminthoid Flysch. Our preliminary data from the shaley series indicate an Albian to Early Campanian age. It represents mid-slope to abyssal plain starved basin sediments. The occurrence of similar and coeval series in the Carpathians and Ligurian Alps suggest common tectonic and oceanographic conditions. 相似文献
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Victor L. Vinograd Bjoern Winkler Daniel J. Wilson Andrew Putnis Julian D. Gale 《Physics and Chemistry of Minerals》2006,33(8-9):533-544
Static lattice energy calculations, based on empirical pair potentials, were performed for a large set of structures differing in the arrangement of octahedral cations within the garnet 2 × 2 × 2 supercell. The compositions of these structures varied between Ca3Fe2Ge3O12 and Ca4Ge4O12. The energies were cluster expanded using pair and quaternary terms. The derived ordering constants were used to constrain Monte Carlo simulations of temperature-dependent mixing properties in the ranges of 1,073–3,673 K and 0–10 GPa. The free energies of mixing were calculated using the method of thermodynamic integration. The calculations predict a wide miscibility gap between Fe-rich (cubic) and Fe-pure (tetragonal) garnets consistent with recent experimental observations of Iezzi et al. (Phys Chem Miner 32:197–207, 2005). It is shown that the miscibility gap arises due to a very strong cation ordering at the Fe-pure composition, driven by the charge difference between Ca2+ and Ge4+ cations. The structural and thermodynamic analogies between Ca–Ge and Mg–Si systems suggest that a similar miscibility gap should exist between pyrope and Mg–Si-majorite. 相似文献
8.
The hydrogeological effectiveness of fracture sets is determined and evaluated by the fuzzy c-mean and hierarchical clustering.
These cluster analyses combine the geological spatial attributes and the hydraulic relevant attributes of fractures. Based
on the results of the clustering the fracture set volumes are estimated. 相似文献
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