Constraints on transport and kinetics in hydrothermal systems from zoned garnet crystals

Zonation of oxygen isotope ratios, fluorine, and rare earth element abundances across garnet crystals from the Permian Oslo Rift reflect temporal variation of the hydrothermal system in which the garnets grew. A sharp rimward decrease in the (18)O/(16)O ratio (of 5 per mil) across the interface between aluminum-rich garnet cores and iron-rich rims indicates influx of meteoric fluids to a system initially dominated by magmatic fluids. This influx may record the transition from ductile to brittle deformation of the hydrothermally altered rocks. In contrast, fluorine and light rare earth element concentrations increase at the core-rim interface. These data may reflect enhanced advective transport and notable kinetic control on trace element uptake by the garnets during brittle deformation.     

Making ceramics "ductile"

Distributed irreversible deformation in otherwise brittle ceramics (specifically, in silicon carbide and micaceous glass-ceramic) has been observed in Hertzian contacts. The deformation takes the form of an expanding microcrack damage zone below the contact circle, in place of the usual single propagating macrocrack (the Hertzian "cone fracture") outside. An important manifestation of this deformation is an effective "ductility" in the indentation stress-strain response. Control of the associated brittle-ductile transition is readily effected by appropriate design of weak interfaces, large and elongate grains, and high internal stresses in the ceramic microstructure.     

Diamond coating of titanium alloys

A titanium alloy was coated with a thin layer of synthetic diamond by chemical vapor deposition methods, achieving exceptional adhesion. Scientific and technological opportunities exist for the development of diamond-coated metal alloys and for a better understanding of adhesion mechanisms of hard, brittle coatings. An indentation method of wide applicability for measuring the adhesion of such coatings is discussed.     

A maximum in the strength of nanocrystalline copper

We used molecular dynamics simulations with system sizes up to 100 million atoms to simulate plastic deformation of nanocrystalline copper. By varying the grain size between 5 and 50 nanometers, we show that the flow stress and thus the strength exhibit a maximum at a grain size of 10 to 15 nanometers. This maximum is because of a shift in the microscopic deformation mechanism from dislocation-mediated plasticity in the coarse-grained material to grain boundary sliding in the nanocrystalline region. The simulations allow us to observe the mechanisms behind the grain-size dependence of the strength of polycrystalline metals.     

Dimples on nanocrystalline fracture surfaces as evidence for shear plane formation

Tensile experiments of fully dense nanocrystalline structures with a mean grain size of less than 100 nanometers demonstrate a considerable increase in hardness but a remarkable drop in elongation-to-failure, indicating brittle behavior. However, dimple structures are often observed at the fracture surface, indicating some type of ductile fracture mechanism. Guided by large-scale atomistic simulations, we propose that these dimple structures result from local shear planes formed around clustered grains that, because of their particular misorientation, cannot participate in the grain boundary accommodation processes necessary to sustain plastic deformation. This raises the expectation that general high-angle grain boundaries are necessary for good ductility.     

Grain boundary decohesion by impurity segregation in a nickel-sulfur system

The sulfur-induced embrittlement of nickel has long been wrapped in mystery as to why and how sulfur weakens the grain boundaries of nickel and why a critical intergranular sulfur concentration is required. From first-principles calculations, we found that a large grain-boundary expansion is caused by a short-range overlap repulsion among densely segregated and neighboring sulfur atoms. This expansion results in a drastic grain-boundary decohesion that reduces the grain-boundary tensile strength by one order of magnitude. This decohesion may directly cause the embrittlement, because the critical sulfur concentration of this decohesion agrees well with experimental data on the embrittlement.     

Atomistic mechanisms and dynamics of adhesion, nanoindentation, and fracture

Molecular dynamics simulations and atomic force microscopy are used to investigate the atomistic mechanisms of adhesion, contact formation, nanoindentation, separation, and fracture that occur when a nickel tip interacts with a gold surface. The theoretically predicted and experimentally measured hysteresis in the force versus tip-to-sample distance relationship, found upon approach and subsequent separation of the tip from the sample, is related to inelastic deformation of the sample surface characterized by adhesion of gold atoms to the nickel tip and formation of a connective neck of atoms. At small tipsample distances, mechanical instability causes the tip and surface to jump-to-contact, which in turn leads to adhesion-induced wetting of the nickel tip by gold atoms. Subsequent indentation of the substrate results in the onset of plastic deformation of the gold surface. The atomic-scale mechanisms underlying the formation and elongation of a connective neck, which forms upon separation, consist of structural transformations involving elastic and yielding stages.     

Revealing extraordinary intrinsic tensile plasticity in gradient nano-grained copper

Nano-grained (NG) metals are believed to be strong but intrinsically brittle: Free-standing NG metals usually exhibit a tensile uniform elongation of a few percent. When a NG copper film is confined by a coarse-grained (CG) copper substrate with a gradient grain-size transition, tensile plasticity can be achieved in the NG film where strain localization is suppressed. The gradient NG film exhibits a 10 times higher yield strength and a tensile plasticity comparable to that of the CG substrate and can sustain a tensile true strain exceeding 100% without cracking. A mechanically driven grain boundary migration process with a substantial concomitant grain growth dominates plastic deformation of the gradient NG structure. The extraordinary intrinsic plasticity of gradient NG structures offers their potential for use as advanced coatings of bulk materials.     

Origin of brittle cleavage in iridium

Iridium is unique among the face-centered cubic metals in that it undergoes brittle cleavage after a period of plastic deformation under tensile stress. Atomistic simulation using a quantum-mechanically derived bond-order potential shows that in iridium, two core structures for the screw dislocation are possible: a glissile planar core and a metastable nonplanar core. Transformation between the two core structures is athermal and leads to exceptionally high rates of cross slip during plastic deformation. Associated with this athermal cross slip is an exponential increase in the dislocation density and strong work hardening from which brittle cleavage is a natural consequence.     

Deformation twinning in nanocrystalline aluminum

We report transmission electron microscope observations that provide evidence of deformation twinning in plastically deformed nanocrystalline aluminum. The presence of these twins is directly related to the nanocrystalline structure, because they are not observed in coarse-grained pure aluminum. We propose a dislocation-based model to explain the preference for deformation twins and stacking faults in nanocrystalline materials. These results underscore a transition from deformation mechanisms controlled by normal slip to those controlled by partial dislocation activity when grain size decreases to tens of nanometers, and they have implications for interpreting the unusual mechanical behavior of nanocrystalline materials.     

Dislocations in complex materials

Deformation of metals and alloys by dislocations gliding between well-separated slip planes is a well-understood process, but most crystal structures do not possess such simple geometric arrangements. Examples are the Laves phases, the most common class of intermetallic compounds and exist with ordered cubic, hexagonal, and rhombohedral structures. These compounds are usually brittle at low temperatures, and transformation from one structure to another is slow. On the basis of geometric and energetic considerations, a dislocation-based mechanism consisting of two shears in different directions on adjacent atomic planes has been used to explain both deformation and phase transformations in this class of materials. We report direct observations made by Z-contrast atomic resolution microscopy of stacking faults and dislocation cores in the Laves phase Cr2Hf. These results show that this complex dislocation scheme does indeed operate in this material. Knowledge gained of the dislocation core structure will enable improved understanding of deformation mechanisms and phase transformation kinetics in this and other complex structures.     

Grain boundary-mediated plasticity in nanocrystalline nickel

The plastic behavior of crystalline materials is mainly controlled by the nucleation and motion of lattice dislocations. We report in situ dynamic transmission electron microscope observations of nanocrystalline nickel films with an average grain size of about 10 nanometers, which show that grain boundary-mediated processes have become a prominent deformation mode. Additionally, trapped lattice dislocations are observed in individual grains following deformation. This change in the deformation mode arises from the grain size-dependent competition between the deformation controlled by nucleation and motion of dislocations and the deformation controlled by diffusion-assisted grain boundary processes.     

青海省粮食供需现状及应对粮食缺口的对策

因自然条件的限制和各种因素影响,青海省粮食生产量近期难以有效提高,供需缺口仍呈钢性增长并将长期存在。应对粮食短缺的对策是:稳定粮食生产,努力减少缺口;健全粮食市场体系,依靠全国粮食大市场,解决青海省粮食短缺问题;发展粮库功能,应对复杂的市场形势,保障粮食安全。     

Superplastic extensibility of nanocrystalline copper at room temperature

A bulk nanocrystalline (nc) pure copper with high purity and high density was synthesized by electrodeposition. An extreme extensibility (elongation exceeds 5000%) without a strain hardening effect was observed when the nc copper specimen was rolled at room temperature. Microstructure analysis suggests that the superplastic extensibility of the nc copper originates from a deformation mechanism dominated by grain boundary activities rather than lattice dislocation, which is also supported by tensile creep studies at room temperature. This behavior demonstrates new possibilities for scientific and technological advancements with nc materials.     

Observations of intergranular stress corrosion cracking in a grain-mapped polycrystal

Nondestructive three-dimensional mapping of grain shape, crystallographic orientation, and grain boundary geometry by diffraction contrast tomography (DCT) provides opportunities for the study of the interaction between intergranular stress corrosion cracking and microstructure. A stress corrosion crack was grown through a volume of sensitized austenitic stainless steel mapped with DCT and observed in situ by synchrotron tomography. Several sensitization-resistant crack-bridging boundaries were identified, and although they have special geometric properties, they are not the twin variant boundaries usually maximized during grain boundary engineering.     

Plastic deformation recovery in freestanding nanocrystalline aluminum and gold thin films

In nanocrystalline metals, lack of intragranular dislocation sources leads to plastic deformation mechanisms that substantially differ from those in coarse-grained metals. However, irrespective of grain size, plastic deformation is considered irrecoverable. We show experimentally that plastically deformed nanocrystalline aluminum and gold films with grain sizes of 65 nanometers and 50 nanometers, respectively, recovered a substantial fraction (50 to 100%) of plastic strain after unloading. This recovery was time dependent and was expedited at higher temperatures. Furthermore, the stress-strain characteristics during the next loading remained almost unchanged when strain recovery was complete. These observations in two dissimilar face-centered cubic metals suggest that strain recovery might be characteristic of other metals with similar grain sizes and crystalline packing.     

Geometric origin of hexagonal close packing at a grain boundary in gold

Using electron microscopy, we identify local, intergranular regions of hexagonal close-packing at a grain boundary in gold. By analyzing the topological defects that connect this layer to the adjacent face-centered cubic grains, we explain the geometric origin of this interfacial reconstruction. We extend this analysis to predict the stacking arrangements found over a range of intergranular misorientations. These results help to unify our understanding of the defects that control the behavior of polycrystalline materials by showing how line defects that are already well understood in the bulk also can determine the atomic arrangements at grain boundaries.     

First principles determination of the effects of phosphorus and boron on iron grain boundary cohesion

Toward an electronic level understanding of intergranular embrittlement and its control in steels, the effects of phosphorus and boron impurities on the energy and electronic properties of both an iron grain boundary and its corresponding intergranular fracture surface are investigated by the local density full potential augmented plane wave method. When structural relaxations are taken into account, the calculated energy difference of phosphorus in the two environments is consistent with its measured embrittlement potency. In contrast to the nonhybridized interaction of iron and phosphorus, iron-boron hybridization permits covalent bonding normal to the boundary contributing to cohesion enhancement. Insights into bonding behavior offer the potential for new directions in alloy composition for improvement of grain boundary-sensitive properties.     

Postseismic mantle relaxation in the Central Nevada Seismic Belt

Holocene acceleration of deformation and postseismic relaxation are two hypotheses to explain the present-day deformation in the Central Nevada Seismic Belt (CNSB). Discriminating between these two mechanisms is critical for understanding the dynamics and seismic potential of the Basin and Range province. Interferometric synthetic aperture radar detected a broad area of uplift (2 to 3 millimeters per year) that can be explained by postseismic mantle relaxation after a sequence of large crustal earthquakes from 1915 to 1954. The results lead to a broad agreement between geologic and geodetic strain indicators and support a model of a rigid Basin and Range between the CNSB and the Wasatch fault.     

Grain boundary strengthening in alumina by rare earth impurities

Impurity doping often alters or improves the properties of materials. In alumina, grain boundaries play a key role in deformation mechanisms, particularly in the phenomenon of grain boundary sliding during creep at high temperatures. We elucidated the atomic-scale structure in alumina grain boundaries and its relationship to the suppression of creep upon doping with yttrium by using atomic resolution microscopy and high-precision calculations. We find that the yttrium segregates to very localized regions along the grain boundary and alters the local bonding environment, thereby strengthening the boundary against mechanical creep.