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71.
Renata M. Wentzcovitch D. A. Hugh-Jones R. J. Angel G. D. Price 《Physics and Chemistry of Minerals》1995,22(7):453-460
We have used a newly developed ab initio constant-pressure molecular dynamics with variable cell shape technique to investigate the zero temperature behaviour of high pressure clinoenstatite (MgSiO3-C2/c) from 0 up to 30 GPa. The optimum structure at 8 GPa, as well as structural trends under pressure, compare very well with experimental data. At this pressure, we find noticeable “fluctuations” in the chain configuration which suggests the structure is on the verge of a mechanical instability. Two distinct compressive behaviours then appear: one below and another above 8 GPa. This phenomenon may be related to the observed transition to a lower symmetry P21/c phase which involves a reconfiguration of the silicate chains, and suggests that the C2/c structure at low pressures found here, may be an artifact of the dynamical algorithm which preserves space group in the absence of symmetry breaking fluctuations. Comparison with calculations in other magnesium silicate phases, indicates that the size and shape of the silicate units (isolated and/or linked tetrahedra and octahedra) are generally well described by the local density approximation; however, the weaker linkages provided by the O-Mg-O bonds, are not as well described. This trend suggests that, as in the recently studied case of H2O-ice, the structural properties of more inhomogeneous systems, like enstatite, may be improved by using gradientcorrected density functionals. 相似文献
72.
Remnants of the Last Interglacial shoreline occur at Middle Lagoon on the far south coast of New South Wales. Relict beach sediments can be traced to a height of at least +4.8 m and are indicative of a former mean sea level of about +3 m. Thermoluminescence (TL) ages of 126 ± 13 ka and 114 ± 15 ka were determined for beach and aeolian facies respectively. Sands in the lower part of an exposure on the adjacent Gillards Beach gave TL ages of 108 ± 13 ka, but sands in the upper part of that exposure gave an age of 19.9 ± 3.5 ka. This chronological evidence of a stratigraphic unconformity in what was initially taken as pedogenic differentiation at Gillards Beach is supported by contrasting electron traps and colour centres in crystal lattices of quartz grains in these two samples. No tectonic displacement is apparent. This site provides the first evidence of the Last Interglacial sea level for 1000 km along the coast between Gippsland and Newcastle. 相似文献
73.
74.
Marian B. Holness M. J. Bickle Colin M. Graham 《Contributions to Mineralogy and Petrology》1991,108(3):356-367
In the aureole of the Beinn an Dubhaich granite, Skye, the minimum observed median forsterite-calcite-calcite dihedral angle
varies from 110° at the olivinein isograd to about 165° (the equilibrium value) at the granite-limestone contact. Laboratory
experiments were performed to investigate the kinetics of this textural change. It was found that the rate of change of the
forsterite-calcite-calcite dihedral angle followed approximately first-order kinetics with an activation energy of 48±4 kJ
mol-1 for fluid-present conditions, and 90 ±4 kJ mol-1 for fluid-absent conditions. Scanning ion imaging demonstrated that, at least in the early stages of textural change, solution-reprecipitation
of the calcite was the rate determining step in the fluid-present runs. The latter result and the value of the activation
energy are both consistent with the activation energy found by previous authors for (albeit zeroth order) silicate-aqueous
solution solution-reprecipitation reactions. The value of activation energy for the dry data does not correspond to those
for either grain boundary or volume diffusion of oxygen or magnesium in forsterite. The mechanism for textural equilibration
in the fluid-absent runs is uncertain. Application of the experimentally-derived rate equation to the Beinn an Dubhaich marbles
gave activation energies higher than those obtained experimentally. It is concluded from consideration of grain growth effects
that activation energies derived from the Beinn an Dubhaich marbles probably reflect textural equilibration under predominantly
fluid-absent conditions. 相似文献
75.
76.
I.Colin Prentice 《Quaternary Research》1985,23(1):76-86
The concepts of pollen source area and of production and dispersal biases in pollen representation are quantified by means of a simple theoretical model. Source areas and relative pollen representation are shown to depend on basin size according to functions that describe the amount of pollen remaining airborne at increasing distances from single pollen sources. The form of these functions is determined by physical processes. Standard formulas for elevated sources do not apply, but the integrated form of Sutton's equation for particle dispersal from a ground-level source gives useful approximations applicable to pollen transport over a forest canopy. Simulations using this equation yielded source areas that increased realistically with basin size, showed substantial differences between source areas for pollen grains with different deposition velocities, and predicted that lighter pollen grains should become better represented with increasing basin size. All of these predictions are qualitatively consistent with present knowledge of the characteristics of pollen assemblages in different depositional environments. The model further allows parameters that can be estimated by statistical calibration methods to be predicted from underlying physical quantities. This extension suggests procedures for testing the theory with quantitative data on surface pollen and forest composition. Preliminary results showed reasonable agreement between estimated and predicted values of dispersal indices for the most abundant taxa in pollen spectra from the northern midwestern United States. 相似文献
77.
The distribution of water within a soil profile can only be partly explained by the time distribution and rate of surface-water input. Observed differences in soil moisture within the unsaturated zone result from the interaction of surface-water inputs with spatially inhomogeneous soil characteristics. Water which initially percolates vertically is differentially impeded as a result of subtle textural changes in the soil, and is then preferentially retained in such zones of transition, causing large differences in soil-water content to occur. The scale of this vertical variability is of tenths of metres, whilst lateral variability of soil moisture reflects textural changes over a few metres. The observed influence of small-scale heterogeneity on soil-water content suggests that the conventional assumptions of isotropicity and homogeneity of the textural and hydraulic properties of porous media used in drainage basin and hillslope hydrological models need scrutiny, even for single stratigraphic units. 相似文献
78.
The aim of the work presented is to develop a computer simulation technique which will predict the structure and physical properties of forsterite and ringwoodite, the major mantle-forming polymorphs of Mg2SiO4. The technique is based upon energy minimization, in which all structural parameters are varied until the configuration with the lowest energy is achieved. The lattice energy and physical properties (e.g. elasticity and dielectric constants) are calculated from interatomic potentials, which generally include electrostatic and short-range terms. We investigate several types of traditional potential models, and present a new type of model which includes partial ionic charges and a Morse potential to describe the effect of covalency on the Si-O bond. This new form of potential model is highly successful, and not only reproduces the zero-pressure structural, elastic and dielectric properties of forsterite and ringwoodite, but also accurately describes their pressure dependence. 相似文献
79.
Colin R. Nash 《Ore Geology Reviews》1986,1(2-4)
Structural analysis of remotely sensed data provides a method of assessing the tectonic significance of regional metallogenic lineaments in the New England Orogen of southeastern Queensland. Photogeological analysis of Landsat imagery and small-scale aerial photography reveals a pattern of WNW—NNW-oriented structures, which were apparently generated in response to Mesozoic crustal extension and reactivated during Early Tertiary block faulting. These structures tend to overprint arcuate late Palaeozoic to early Mesozoic trends and batholith belts, and exert a control over Middle to Late Triassic rifting and epizonal plutonism. The distribution of epigenetic base and precious metal deposits in the Rockhampton—Maryborough area is locally but not regionally related to identifiable structural lineaments. 相似文献
80.
Colin G. Moore Scot Mathieson David J. L. Mills Brian J. Bett 《Marine pollution bulletin》1987,18(12):646-649
A methodology is presented for the estimation of nematode diversity using Cairns' technique of sequential comparisons. The accuracy and precision of the method are examined and a test presented for the comparison of diversity estimates. 相似文献