共查询到20条相似文献，搜索用时 31 毫秒
1.
D. J. Barber H.-R. Wenk J. Gomez-Barreiro E. Rybacki G. Dresen 《Physics and Chemistry of Minerals》2007,34(2):73-84
The deformation behavior of calcite has been of longstanding interest. Through experiments on single crystals, deformation
mechanisms were established such as mechanical twinning on
in the positive sense and slip on
and
both in the negative sense. More recently it was observed that at higher temperatures
slip in both senses becomes active and, based on slip line analysis, it was suggested that
slip may occur. So far there had been no direct evidence for basal slip, which is the dominant system in dolomite. With new
torsion experiments on calcite single crystals at 900 K and transmission electron microscopy, this study identifies
slip unambiguously by direct imaging of dislocations and diffraction contrast analysis. Including this slip system in polycrystal
plasticity simulations, enigmatic texture patterns observed in compression and torsion of calcite rocks at high temperature
can now be explained, resolving a long-standing puzzle. 相似文献
2.
Jason B. Burt Nancy L. Ross G. V. Gibbs George R. Rossman Kevin M. Rosso 《Physics and Chemistry of Minerals》2007,34(5):295-306
Potential protonation sites for, kyanite, sillimanite, and andalusite, located in a mapping of the (3, −3) critical points
displayed by their L(r) = −∇2ρ(r) distributions, are compared with polarized single-crystal FTIR spectra of kyanite and sillimanite determined earlier and
with andalusite measured in this study. For andalusite, seven peaks were observed when the electric vector, E, is parallel to [100]: four intense ones at 3,440, 3,460, 3,526, and 3,597 cm−1 and three weaker ones at 3,480, 3,520, and 3,653 cm−1. Six peaks, three intense ones at 3,440, 3,460, and 3,526 cm−1 and three weaker ones at 3,480, 3,520, and 3,653 cm−1 when E parallels [010]. No peaks were observed when E is parallel to [001]. The concentration of water in andalusite varies between 110 and 168 ppm by weight % H2O. Polarized FTIR spectra indicate that the OH vector is parallel to (001) in andalusite and sillimanite and
in kyanite. Examination of the L(r) (3, −3) critical points in comparison with the polarized FTIR indicates that H prefers to bond to the oxygen atoms O1 and
O2 in andalusite and O2 and O4 in sillimanite which correspond to the underbonded oxygen atoms and those with the largest
L(r) maxima. In kyanite, comparison of the FTIR spectrum and the critical points indicates that H will preferentially bond to
the two 4-coordinated O2 and O6 atoms. 相似文献
3.
Transmission electron microscopy on the iron monosulfide (FeS) varieties from the Suizhou meteorite (Hubei, China) reveals
the intergrowth of primary hexagonal 2C troilite
and minor monoclinic 4C pyrrhotite (SG: F2/d) phases as nanometer-scale domain microstructure. In addition, anti-phase domain boundaries are found to present in the 2C
troilite superstructure with the displacement vector 1/4[001]2C, which is expected to form during the translational symmetry breaking during cooling from higher symmetry, high-temperature
modification of the NiAs-type (SG: P63/mmc) structure. Furthermore, 60° rotation twinning about the pseudo-hexagonal c-axis is observed in the 4C pyrrhotite superstructure, which may result from rotation symmetry reduction induced by the ordered
arrangements of metal vacancies through solid-state transformation during further cooling. All the above microstructural characteristics
are discussed with consideration to the thermal metamorphism history experienced by the Suizhou meteorite. 相似文献
4.
Jens Wenzel Andreasen Emil Makovicky Bente Lebech Sven Karup Møller 《Physics and Chemistry of Minerals》2008,35(8):447-454
Rietveld refinement of neutron powder diffraction data on four samples of synthetic, iron-bearing tetrahedrite (Cu12?xFexSb4S13) with x = 0.28, 0.69, 0.91, 2.19 and four samples of synthetic tennantite (Cu12?xFexAs4S13) with x = 0.33, 0.38, 0.86, 1.5 indicate unambiguously that iron is incorporated into tetrahedral M1 (12d) sites and not into triangular M2 (12e) sites in the cubic crystal structure (space group I $ \ifmmode\expandafter\bar\else\expandafter\=\fi{4} Rietveld refinement of neutron powder diffraction data on four samples of synthetic, iron-bearing tetrahedrite (Cu12−xFexSb4S13) with x = 0.28, 0.69, 0.91, 2.19 and four samples of synthetic tennantite (Cu12−xFexAs4S13) with x = 0.33, 0.38, 0.86, 1.5 indicate unambiguously that iron is incorporated into tetrahedral M1 (12d) sites and not into triangular M2 (12e) sites in the cubic crystal structure (space group I 3 m). The refinement results also confirm that M2 is a split (24g), flat-pyramidal site situated statistically on both sides of the S1−S1–S2 triangle. In tetrahedrite, this split is about
0.6 ?, in tennantite about 0.7 ?. Trends in bond lengths and magnitude of the M2 split were evaluated by means of linear regression
with Fe concentration as the independent variable. 相似文献
5.
The diffusion of water in a peralkaline and a peraluminous rhyolitic melt was investigated at temperatures of 714–1,493 K
and pressures of 100 and 500 MPa. At temperatures below 923 K dehydration experiments were performed on glasses containing
about 2 wt% H2O
t
in cold seal pressure vessels. At high temperatures diffusion couples of water-poor (<0.5 wt% H2O
t
) and water-rich (~2 wt% H2O
t
) melts were run in an internally heated gas pressure vessel. Argon was the pressure medium in both cases. Concentration profiles
of hydrous species (OH groups and H2O molecules) were measured along the diffusion direction using near-infrared (NIR) microspectroscopy. The bulk water diffusivity
() was derived from profiles of total water () using a modified Boltzmann-Matano method as well as using fittings assuming a functional relationship between and Both methods consistently indicate that is proportional to in this range of water contents for both bulk compositions, in agreement with previous work on metaluminous rhyolite. The
water diffusivity in the peraluminous melts agrees very well with data for metaluminous rhyolites implying that an excess
of Al2O3 with respect to alkalis does not affect water diffusion. On the other hand, water diffusion is faster by roughly a factor
of two in the peralkaline melt compared to the metaluminous melt. The following expression for the water diffusivity in the
peralkaline rhyolite as a function of temperature and pressure was obtained by least-squares fitting:
where is the water diffusivity at 1 wt% H2O
t
in m2/s, T is the temperature in K and P is the pressure in MPa. The above equation reproduces the experimental data (14 runs in total) with a standard fit error
of 0.15 log units. It can be employed to model degassing of peralkaline melts at water contents up to 2 wt%. 相似文献
6.
Melchor González-Dávila J. Magdalena Santana-Casiano Frank J. Millero 《Aquatic Geochemistry》2007,13(4):339-355
The thermodynamic stability constants for the hydrolysis and formation of mercury (Hg2+) chloride complexes
have been used to calculate the activity coefficients for Hg(OH)
n
(2–n)+ and HgCl
n
(2–n)+ complexes using the Pitzer specific interaction model. These values have been used to determine the Pitzer parameters for
the hydroxide and chloro complexes and C
ML). The values of and have been determined for the neutral complexes (Hg(OH)2 and HgCl2). The resultant parameters yield calculated values for the measured values of log to ±0.01 from I = 0.1 to 3 m at 25°C. Since the activity coefficients of and are in reasonable agreement with the values for Pb(II), we have estimated the effect of temperature on the chloride constants
for Hg(II) from 0 to 300°C and I = 0–6 m using the Pitzer parameters for complexes. The resulting parameters can be used to examine the speciation of Hg(II) with Cl− in natural waters over a wide range of conditions. 相似文献
7.
A critical look at representations of urban areas in global maps 总被引：10，自引：0，他引：10
According to the UN, the number of urban dwellers is expected to increase from roughly 3.2 billion today to more than 4.9 billion by 2030. An accurate and regularly updated estimate of the extent and spatial distribution of urban land is an important first step in our search for realistic responses to the ecological and social consequences of what promises to be the most rapid urbanization in world history. By employing circa-2000 satellite remote sensing imagery, geographic information systems, and census data, six groups from government and academia in both the EU and the US have created global maps that can be used to describe urban land. We compare these maps from global to sub-national scales, for the first time applying Discrete Global Grids to the problem of global-scale map comparison. Although most of these maps share common data inputs, they differ by as much as an order of magnitude in their estimates of the total areal extent of the Earth’s urban land (from 0.27 to 3.52 million km2). A sub-national analysis of the spatial distribution of urban land reveals that inter-map correlations are highest in North America ( $ \ifmmode\expandafter\bar\else\expandafter\=\fi{r} $ = 0.90), intermediate in Europe, South and Central America, and Sub-Saharan Africa ( $ \ifmmode\expandafter\bar\else\expandafter\=\fi{r} $ = 0.78), and lowest in Asia ( $ \ifmmode\expandafter\bar\else\expandafter\=\fi{r} $ = 0.63). Across most regions, our analysis uncovers a degree of variance that is high enough to call into question the consistency of each group’s approach to urban land, pointing to the need for both a common urban taxonomy and a global urban assessment effort. 相似文献
8.
We present here a numerical modelling study of dislocations in perovskite CaTiO3. The dislocation core structures and properties are calculated through the Peierls–Nabarro model using the generalized stacking
fault (GSF) results as a starting model. The GSF are determined from first-principles calculations using the VASP code. The
dislocation properties such as collinear, planar core spreading and Peierls stresses are determined for the following slip
systems: [100](010), [100](001), [010](100), [010](001), [001](100), [001](010),
and All dislocations exhibit lattice friction, but glide appears to be easier for [100](010) and [010](100).
[001](010) and [001](100) exhibit collinear dissociation. Comparing Peierls stresses among tausonite (SrTiO3), perovskite (CaTiO3) and MgSiO3 perovskite demonstrates the strong influence of orthorhombic distortions on lattice friction. However, and despite some quantitative
differences, CaTiO3 appears to be a satisfactory analogue material for MgSiO3 perovskite as far as dislocation glide is concerned. 相似文献
9.
10.
Roger H. Mitchell Malcolm Alexander Lachlan M. D. Cranswick Ian P. Swainson 《Physics and Chemistry of Minerals》2007,34(10):705-712
The cell dimensions and crystal structures of the fluoroperovskite NaMgF3 (neighborite), synthesized by solid state methods, have been determined by powder neutron diffraction and Rietveld refinement
over the temperature range 300–3.6 K using Pt metal as an internal standard for calibration of the neutron wavelength. These
data show that Pbnm NaMgF3 does not undergo any phase transitions to structures of lower symmetry with decreasing temperature. The cell dimensions and
atomic coordinates together with polyhedron volumes and distortion indices are given for Pbnm NaMgF3 at 25 K intervals from 300 to 3.6 K. Decreases in the a and c cell dimensions reach a saturation point at 50 K, whereas the b dimension becomes saturated at 150 K. The distortion of the structure of Pbnm NaMgF3 from the aristotype cubic
structure is described in terms of the tilting of the MgF6 octahedra according to the tilt scheme a
−
a
−
c
+
. With decreasing temperature the antiphase tilt (a
−) increases from 14.24° to 15.39°, whereas the in-phase tilt (c
+
) remains effectively constant at ∼10.7°. Changes in the tilt angles are insufficient to cause changes in the coordination
sphere of Na that might induce a low temperature phase transition. The structure of Pbnm NaMgF3 is also described in terms of normal mode analysis and displacements of the condensed normal modes are compared with those
of Pbnm KCaF3. 相似文献
11.
A modified cross-twinning growth mechanism is put forward to explain the anomalous morphology of a spinel multiple-twin from Sri Lanka, flattened crosswise the twin
planes. Cross-twinning in spinel was found also in other specimens from Pegu (Myanmar), and the results were published in
a previous paper. This particular type of twinning is derived from the combination of cyclic
twinning with lamellar
twinning, so that these samples may be thought of as partial fivelings (cubic cyclic {111} twins with five components sharing a common <110> pseudo-fivefold axis). In the present paper, the sample
from Sri Lanka has been suitably cut with the aim of focusing the study on the cross-twinning region. The transformation matrices
that link the orientation states of each couple of twin components have been determined by means of White Beam Synchrotron
Radiation Topography. They showed that the specimen is made up of four twin components (A, B, C and D), with three twin planes:
and They also showed that the cross-twinned individuals (B and D) actually are not twinned to each other, and that a simple crystallographic
relationship holds between them. X-ray diffraction topography by conventional source allowed to image the crossing-region
and to determine that the cross-twinned individuals are in contact through a semi-coherent boundary, with twinning dislocations contributing to relieve the coherency strains. Electron probe microanalyses with wave dispersive spectroscopy showed that
the chemical composition is almost homogeneous, at least within the spatial resolution limit of this technique. The similar
growth features observed in the spinel sample from Sri Lanka and in those from Myanmar are interpreted as growth marks, indicators of a similar origin: in both cases they are found in impure dolomitic marbles. In particular, the specimen from
Sri Lanka results from the interaction of thermal and metasomatic effects due to contact metamorphism. An unusual stepped
morphology of the face close to the twin boundary, possibly due to corrosion and re-growth processes acted preferentially at a re-entrant corner by metasomatic
fluids, is interpreted as indicator of a metasomatic event that succeeded to the crystal growth, the latter occurred by thermal
effect.
相似文献
| Rosa Anna FregolaEmail: |
12.
The stability and the thermo-elastic behaviour of a natural londonite
|
[1a ( Cs0.36 K0.34 Rb0.15 Ca0.04 Na0.02 )S0.914e ( Al3.82 Li0.05 Fe0.02 )S3.894e ( Be3.82 B0.18 )S412h ( B10.97 Be1 Si0.01 )S11.98 O28] [^{{1a}} \left( {Cs_{{0.36}} K_{{0.34}} Rb_{{0.15}} Ca_{{0.04}} Na_{{0.02}} } \right)_{\Sigma 0.91}{}^{{4e}} \left( {Al_{{3.82}} Li_{{0.05}} Fe_{{0.02}} } \right)_{{\Sigma 3.89}}{}^{{4e}} \left( {Be_{{3.82}} B_{{0.18}} } \right)_{{\Sigma 4}}{}^{{12h}} \left( {B_{{10.97}} Be_{1} Si_{{0.01}} } \right)_{{\Sigma 11.98}} O_{{28}}] 相似文献
13.
The full set of elastic constants for plagioclase end-member phase albite (NaAlSi3O8) is reported for the first time. Velocities of surface acoustic waves (both Rayleigh and pseudo-surface waves) were measured using impulsively stimulated light scattering on polished surfaces having six different orientations (three normal to the Cartesian axes and three lying on diagonals). Data were inverted and results tested using several non-linear optimization techniques. Compliance moduli determined under hydrostatic compression provided additional constraints and reduced covariance in the reported constants. The Cartesian coordinate system associated with the constants (using the
unit cell) has the y-axis parallel to the crystal b axis, the x-axis parallel to a* (perpendicular to b and c) and the z-axis consistent with a right-handed coordinate system. The values of the moduli C11, C12, C13, C14, C15, C16, C22, C23, C24, C25, C26, C33, C34, C35, C36, C44, C45, C46, C55, C56, C66 and their 2σ uncertainties (in parentheses) are, respectively, 69.1(0.6), 34.0(0.7), 30.8(0.5), 5.1(0.1), −2.4(0.1), −0.9(0.1), 183.5(2.7), 5.5(2.2), −3.9(0.5), −7.7(0.7), −5.8(0.7), 179.5(2.3), −8.7(0.4), 7.1(0.6), −9.8(0.6), 24.9(0.1), −2.4(0.1), −7.2(0.1), 26.8 (0.2), 0.5(0.1), 33.5(0.2). These constants differ significantly from the previously reported pseudo-monoclinic constants that were based on velocity measurements on polysynthetic twinned crystal aggregates. Differences are consistent with systematic errors in the earlier study associated with sparse data and the presence of cracks and other imperfections. 相似文献
14.
The effect of H<Subscript>2</Subscript>O on the olivine liquidus of basaltic melts: experiments and thermodynamic models 总被引：2，自引：2，他引：0
We designed and carried out experiments to investigate the effect of H2O on the liquidus temperature of olivine-saturated primitive melts. The effect of H2O was isolated from other influences by experimentally determining the liquidus temperatures of the same melt composition
with various amounts of H2O added. Experimental data indicate that the effect of H2O does not depend on pressure or melt composition in the basaltic compositional range. The influence of H2O on melting point lowering can be described as a polynomial function
This expression can be used to account for the effect of H2O on olivine-melt thermometers, and can be incorporated into fractionation models for primitive basalts. The non-linear effect
of H2O indicates that incorporation of H2O in silicate melts is non-ideal, and involves interaction between H2O and other melt components. The simple speciation approach that seems to account for the influence of H2O in simple systems (albite-H2O, diopside-H2O) fails to describe the mixing behavior of H2O in multi-component silicate melts. However, a non-ideal solution model that treats the effect of H2O addition as a positive excess free energy can be fitted to describe the effect of melting point lowering. 相似文献
15.
The Fe3+/Fetot of all Fe-bearing minerals has been analysed by Mössbauer spectroscopy in a suite of biotite-rich to biotite-free graphitic metapelite xenoliths, proxies of an amphibolite-granulite transition through progressive biotite melting. Biotite contains 9 to 16% Fe3+/Fetot, whereas garnet, cordierite and ilmenite are virtually Fe3+ -free (0–1% Fe3+/Fetot) in all samples, regardless of biotite presence. Under relatively reducing conditions (graphite-bearing assemblages), biotite is the only carrier of Fe3+ during high-temperature metamorphism; therefore, its disappearance by melting represents an important event of iron reduction during granulite formation, because haplogranitic melts usually incorporate small amounts of ferric iron. Iron reduction is accompanied by the oxidation of carbon and the production of CO2, according to the redox reaction:
16.
The pressure–volume–temperature (P–V–T) relation of CaIrO3 post-perovskite (ppv) was measured at pressures and temperatures up to 8.6 GPa and 1,273 K, respectively, with energy-dispersive synchrotron X-ray diffraction using a DIA-type, cubic-anvil apparatus (SAM85). Unit-cell dimensions were derived from the Le Bail full profile refinement technique, and the results were fitted using the third-order Birth-Murnaghan equation of state. The derived bulk modulus \( K_{T0} \) at ambient pressure and temperature is 168.3 ± 7.1 GPa with a pressure derivative \( K_{T0}^{\prime } \) = 5.4 ± 0.7. All of the high temperature data, combined with previous experimental data, are fitted using the high-temperature Birch-Murnaghan equation of state, the thermal pressure approach, and the Mie-Grüneisen-Debye formalism. The refined thermoelastic parameters for CaIrO3 ppv are: temperature derivative of bulk modulus \( (\partial K_{T} /\partial T)_{P} \) = ?0.038 ± 0.011 GPa K?1, \( \alpha K_{T} \) = 0.0039 ± 0.0001 GPa K?1, \( \left( {\partial K_{T} /\partial T} \right)_{V} \) = ?0.012 ± 0.002 GPa K?1, and \( \left( {\partial^{2} P/\partial T^{2} } \right)_{V} \) = 1.9 ± 0.3 × 10?6 GPa2 K?2. Using the Mie-Grüneisen-Debye formalism, we obtain Grüneisen parameter \( \gamma_{0} \) = 0.92 ± 0.01 and its volume dependence q = 3.4 ± 0.6. The systematic variation of bulk moduli for several oxide post-perovskites can be described approximately by the relationship K T0 = 5406.0/V(molar) + 5.9 GPa. 相似文献
17.
18.
Phase-transformation-induced twins in pressureless-sintered lanthanum gallate (LaGaO3) ceramics have been analysed using the transmission electron microscopy (TEM). Twins are induced by solid state phase transformation upon cooling from the rhombohedral
to orthorhombic (o, Pnma) symmetry at ∼145°C. Three types of transformation twins {101}
o
, {121}
o
, and {123}
o
were found in grains containing multiple domains that represent orientation variants. Three orthorhombic orientation variants were distinguished from the transformation domains converged into a triple junction. These twins are the reflection type as confirmed by tilting experiment in the microscope. Although not related by group–subgroup relation, the transformation twins generated by phase transition from rhombohedral to orthorhombic are consistent with those derived from taking cubic
aristotype of the lowest common supergroup symmetry as an intermediate metastable structure. The r→ o phase transition of first order in nature may have occurred by a diffusionless, martensitic-type or discontinuous nucleation and growth mechanism. 相似文献
19.
Mineral-specific IR absorption coefficients were calculated for natural and synthetic olivine, SiO2 polymorphs, and GeO2 with specific isolated OH point defects using quantitative data from independent techniques such as proton–proton scattering,
confocal Raman spectroscopy, and secondary ion mass spectrometry. Moreover, we present a routine to detect OH traces in anisotropic
minerals using Raman spectroscopy combined with the “Comparator Technique”. In case of olivine and the SiO2 system, it turns out that the magnitude of ε for one structure is independent of the type of OH point defect and therewith
the peak position (quartz ε = 89,000 ± 15,000
\textl \textmol\textH2\textO-1 \textcm-2\text{l}\,\text{mol}_{{\text{H}_2}\text{O}}^{-1}\,\text{cm}^{-2}), but it varies as a function of structure (coesite ε = 214,000 ± 14,000
\textl \textmol\textH2\textO-1 \textcm-2\text{l}\,\text{mol}_{{\text{H}_2}\text{O}}^{-1}\,\text{cm}^{-2}; stishovite ε = 485,000 ± 109,000
\textl \textmol\textH2\textO-1 \textcm-2\text{l}\,\text{mol}_{{\text{H}_2}\text{O}}^{-1}\,\text{cm}^{-2}). Evaluation of data from this study confirms that not using mineral-specific IR calibrations for the OH quantification in
nominally anhydrous minerals leads to inaccurate estimations of OH concentrations, which constitute the basis for modeling
the Earth’s deep water cycle. 相似文献
20.
Crystals of hydronium jarosite were synthesized by hydrothermal treatment of Fe(III)–SO4 solutions. Single-crystal XRD refinement with R1=0.0232 for the unique observed reflections (|Fo| > 4F) and wR2=0.0451 for all data gave a=7.3559(8) Å, c=17.019(3) Å, Vo=160.11(4) cm3, and fractional positions for all atoms except the H in the H3O groups. The chemical composition of this sample is described by the formula (H3O)0.91Fe2.91(SO4)2[(OH)5.64(H2O)0.18]. The enthalpy of formation (Hof) is –3694.5 ± 4.6 kJ mol–1, calculated from acid (5.0 N HCl) solution calorimetry data for hydronium jarosite, -FeOOH, MgO, H2O, and -MgSO4. The entropy at standard temperature and pressure (So) is 438.9±0.7 J mol–1 K–1, calculated from adiabatic and semi-adiabatic calorimetry data. The heat capacity (Cp) data between 273 and 400 K were fitted to a Maier-Kelley polynomial Cp(T in K)=280.6 + 0.6149T–3199700T–2. The Gibbs free energy of formation is –3162.2 ± 4.6 kJ mol–1. Speciation and activity calculations for Fe(III)–SO4 solutions show that these new thermodynamic data reproduce the results of solubility experiments with hydronium jarosite. A spin-glass freezing transition was manifested as a broad anomaly in the Cp data, and as a broad maximum in the zero-field-cooled magnetic susceptibility data at 16.5 K. Another anomaly in Cp, below 0.7 K, has been tentatively attributed to spin cluster tunneling. A set of thermodynamic values for an ideal composition end member (H3O)Fe3(SO4)2(OH)6 was estimated: Gof= –3226.4 ± 4.6 kJ mol–1, Hof=–3770.2 ± 4.6 kJ mol–1, So=448.2 ± 0.7 J mol–1 K–1, Cp (T in K)=287.2 + 0.6281T–3286000T–2 (between 273 and 400 K). 相似文献
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