Nanograin Size Effects on the Strength of Biphase Nanolayered Composites

In this work, we employ atomic-scale simulations to uncover the interface-driven deformation mechanisms in biphase nanolayered composites. Two internal boundaries persist in these materials, the interlayer crystalline boundaries and intralayer biphase interfaces, and both have nanoscale dimensions. These internal surfaces are known to control the activation and motion of dislocations, and despite the fact that most of these materials bear both types of interfaces. From our calculations, we find that the first defect event, signifying yield, is controlled by the intralayer spacing (grain size, d), and not the intralayer biphase spacing (layer thickness, h). The interplay of two internal sizes leads to a very broad transition region from grain boundary sliding dominated flow, where the material is weak and insensitive to changes in h, to grain boundary dislocation emission and glide dominated flow, where the material is strong and sensitive to changes in h. Such a rich set of states and size effects are not seen in idealized materials with one of these internal surfaces removed. These findings provide some insight into how changes in h and d resulting from different synthesis processes can affect the strength of nanolayered materials

A Simple Model for Elastic-Plastic Contact of Granular Geomaterials

We propose a simple elastic-plastic contact model by considering the interaction of two spheres in the normal direction, for use in discrete element method (DEM) simulations of geomaterials. This model has been developed by using the finite element method (FEM) and nonlinear fitting methods, in the form of power-law relation of the dimensionless normal force and displacement. Only four parameters are needed for each loading-unloading contact process between two spheres, which are relevant to material properties evaluated by FEM simulations. Within the given range of material properties, those four parameters can be quickly accessed by interpolating the data appended or by regression functions supplied. Instead of the Von Mises (V-M) yield criterion, the Drucker-Prager (D-P) criterion is used to describe the yield behavior of contacting spheres in this model. The D-P criterion takes the effects of confining pressure, the intermediate principal stress, and strain rate into consideration; thus, this model can be used for DEM simulation of geomaterials as well as other granular materials with pressure sensitivity

Two Novel AGXT Mutations Cause the Infantile Form of Primary Hyperoxaluria Type I in a Chinese Family: Research on Missed Mutation

Primary hyperoxaluria type 1 (PH1) is a rare metabolic disorder characterized by a defect in the liver-specific peroxisomal enzyme alanine-glyoxylate and serine-pyruvate aminotransferase (AGT). This disorder results in hyperoxaluria, recurrent urolithiasis, and nephrocalcinosis. Three forms of PH1 have been reported. Data on the infantile form of PH1 are currently limited in literature. Despite the fact that China is the most populated country in the world, only a few AGXT mutations have been reported in several Chinese PH1 patients. In the present study, we investigated a Chinese family in which two siblings are affected by the infantile form of PH1. Sanger sequencing was carried out on the proband, but the results were misleading. Two novel missense mutations (c.517T > C/p.Cys173Arg and c.667A > C/p.Ser223Arg) of the AGXT gene were successfully detected through whole-exome sequencing. These two mutations occurred in the highly conserved residues of the AGT. Four software programs predicted both mutations as the cause of the disease. A postmortem examination was performed and revealed the occurrence of global nephrocalcinosis on both kidneys. The crystals were collected and analyzed as calcium oxalate monohydrate. This study extends the knowledge on the clinical phenotype–genotype correlation of the AGXT mutation. That is, (i) two novel missense mutations were identified for the infantile form of PH1 and (ii) the same AGXT genotype caused the same infantile form of PH1 within the family

Bergmann Glia and the Recognition Molecule CHL1 Organize GABAergic Axons and Direct Innervation of Purkinje Cell Dendrites

The geometric and subcellular organization of axon arbors distributes and regulates electrical signaling in neurons and networks, but the underlying mechanisms have remained elusive. In rodent cerebellar cortex, stellate interneurons elaborate characteristic axon arbors that selectively innervate Purkinje cell dendrites and likely regulate dendritic integration. We used GFP BAC transgenic reporter mice to examine the cellular processes and molecular mechanisms underlying the development of stellate cell axons and their innervation pattern. We show that stellate axons are organized and guided towards Purkinje cell dendrites by an intermediate scaffold of Bergmann glial (BG) fibers. The L1 family immunoglobulin protein Close Homologue of L1 (CHL1) is localized to apical BG fibers and stellate cells during the development of stellate axon arbors. In the absence of CHL1, stellate axons deviate from BG fibers and show aberrant branching and orientation. Furthermore, synapse formation between aberrant stellate axons and Purkinje dendrites is reduced and cannot be maintained, leading to progressive atrophy of axon terminals. These results establish BG fibers as a guiding scaffold and CHL1 a molecular signal in the organization of stellate axon arbors and in directing their dendritic innervation

A proposal for a coordinated effort for the determination of brainwide neuroanatomical connectivity in model organisms at a mesoscopic scale

In this era of complete genomes, our knowledge of neuroanatomical circuitry remains surprisingly sparse. Such knowledge is however critical both for basic and clinical research into brain function. Here we advocate for a concerted effort to fill this gap, through systematic, experimental mapping of neural circuits at a mesoscopic scale of resolution suitable for comprehensive, brain-wide coverage, using injections of tracers or viral vectors. We detail the scientific and medical rationale and briefly review existing knowledge and experimental techniques. We define a set of desiderata, including brain-wide coverage; validated and extensible experimental techniques suitable for standardization and automation; centralized, open access data repository; compatibility with existing resources, and tractability with current informatics technology. We discuss a hypothetical but tractable plan for mouse, additional efforts for the macaque, and technique development for human. We estimate that the mouse connectivity project could be completed within five years with a comparatively modest budget.Comment: 41 page

Fracture Resistance of Cu/Nb Metallic Nanolayered Composite

In this work, molecular dynamics simulations to explore the crack propagation and fracture behavior of Cu/Nb metallic nanolayered composites (MNCs) were performed. The results of this study are consistent with the previous experimental results, which illustrated that cracks in Cu and Nb layers may exhibit different propagation paths and distances under the isostrain loading condition. The analysis reveals that the interface can increase the fracture resistance of the Nb layer in Cu/Nb MNCs by providing the dislocation sources to generate the plastic strain at the front of the crack. Increasing the layer thickness can enhance the fracture resistance of both Cu and Nb layers, as the critical stress for activating the dislocation motion decreases with the increment of the layer thickness. In addition, grain boundaries (GBs) in polycrystalline Cu/Nb samples would decrease the fracture resistance of Nb layer by promoting the crack propagate along the GBs, i.e., intergranular fracture, while the effect of interface and layer thickness on the fracture resistance of MNCs will not be altered by introducing the GBs in MNCs

Modeling and Simulation of Nanoindentation

Nanoindentation is a hardness test method applied to small volumes of material which can provide some unique effects and spark many related research activities. To fully understand the phenomena observed during nanoindentation tests, modeling and simulation methods have been developed to predict the mechanical response of materials during nanoindentation. However, challenges remain with those computational approaches, because of their length scale, predictive capability, and accuracy. This article reviews recent progress and challenges for modeling and simulation of nanoindentation, including an overview of molecular dynamics, the quasicontinuum method, discrete dislocation dynamics, and the crystal plasticity finite element method, and discusses how to integrate multiscale modeling approaches seamlessly with experimental studies to understand the length-scale effects and microstructure evolution during nanoindentation tests, creating a unique opportunity to establish new calibration procedures for the nanoindentation technique

Effect of Plastic Incompatibility on the Strain Hardening Behavior of Al-TiN Nanolayered Composites

The strain hardening behavior of Al-TiN nanolayered composites induced by plastic incompatibility was studied by 3-D discrete dislocation dynamics (DDD) simulations. Our simulations results indicate the strain hardening rate solely induced by the plastic incompatibility is independent of layer thickness and dislocation density at a constant layer thickness ratio, while the yield stress exhibits a strong size effect. Furthermore, the strain hardening rate increases with decreasing Al/TiN layer thickness ratio and our predicted results match well with prior experiment data

Deformation of Heterogeneous Nanocrystalline Lamella with a Preexisting Crack

Molecular dynamics simulations were performed on heterogeneous nanocrystalline Al lamellae composed of nanocrystalline (NC) and single-crystalline (SC) layers to study the effect of the heterogeneous microstructures on the propagation of preexisting cracks. Under tensile loading, the heterogeneous NC Al lamella exhibited higher crack growth resistance than the pure NC Al. In addition, a lower volume fraction of the NC layer provided better crack growth resistance in heterogeneous lamellae (HL) samples, which agrees well with previous experiment results. After analyzing the distribution of the atom-level virial stress and microstructure evolution during the deformation, we found that the average stress on grain boundary atoms was much lower in HL samples than that in pure NC sample. When the crack approaches the interface, the heterogeneous microstructure can reduce the stress concentration by emitting dislocations from the interface into the SC layer

Unusual Size Effects from Tilted Twin Boundaries in Nano-Twinned Metals

Tilted twin boundaries (TBs), whose plane normals are rotated at an angle from the parent grain axis, naturally occur in columnar-grained, nano-twinned (NT) metals. Here, using a combination of atomistic simulations and analytical modeling, we reveal that NT metals with the ideal, non-tilted TBs exhibit continuously increasing strength with decreasing twin thickness, and hence, no inverse twin thickness size effect on strength. In contrast, NT metals with tilted TBs exhibit an inverse size effect, and the critical twin thickness, below which strength decreases, increases as the TB-tilt angle increases. The analysis also identifies a critical value of TB tilt, for which strength becomes independent of twin thickness and is the weakest. The transition arises from a change in dislocation activity prevailing mostly on planes inclined to TBs to planes parallel to the TBs. These findings reveal a profound influence of TB tilt angle that could redirect the analysis and engineering of nano-twin structures