Behaviour of an edge dislocation in a semi-infinite solid with surface energy effects

The method of continuously distributed dislocations and the method of discrete distribution of dislocations have been used to determine the effect of surface energy on the surface boundary conditions of a semi-infinite solid containing an edge dislocation. The surface dislocation model which incorporates two surface dislocation arrays, the primary and the secondary, in order of importance, is used to study the effect of surface energy. The surface dislocation model in conjunction with the method of continuously distributed dislocations enables the exact determination of the dislocation distribution function of the primary and secondary dislocation arrays and the effect of surface energy tends to lower both the total Burgers vector associated with the surface arrays and dislocations in evaluating the effect of surface energy is illustrated and is compared with the method of continuously distributed dislocations. It has been found that the surface energy tends to lower both the total Burgers vector associated with the surface arrays and the length of the region within which they are spread on the surface. Although the effect on the primary surface arrays is not very large, the secondary surface arrays are completely eliminated with normal values of surface energy encountered in real solids. Thus, the effect of surface energy is to bring non-vanishing stress components to the surface. The surface is also non-uniformly stressed. The superiority of the surface dislocation model over the other methods hitherto used in the literature is illustrated.     

Further refinements in the energy of grain boundaries

Earlier surface dislocation analysis of a grain boundary recognized the tendency of the grain-boundary surfaces to coalesce in order to reduce surface energy. The coalescence process is described by a distribution of surface dislocations on the grain-boundary surfaces. In the present paper, previous analysis is further refined. In particular, the sum of the Burgers vectors of the surface array of grain-boundary dislocations is not equal to the Burgers vector of the grain-boundary lattice dislocation. Instead, the Burgers vector of the surface array is determined as a function of the coalescence of the grain-boundary surfaces. The conservation of Burgers vectors of dislocations is used to predict the presence of a screening array of dislocations. The screening array of dislocations is determined by minimization of the total energy of the configuration. The distortion around the boundary is relaxed by the screening array. In general, the distribution of the screening array is two dimensional. This result has been proved by the presence of a minimum energy configuration for two sets of screening arrays of dislocations situated at different distances from the boundary.     

Calculation of the interaction energy of the twinning dislocations of a wedge twin based on the mesoscopic dislocation model

The energy of interaction of the twinning dislocations in a wedge crystal twin was calculated based on the mesoscopic dislocation model. It has been established that the interaction energy of the twinning dislocations increases moderately with increase in the length of the twin. It is shown that the dependence of the interaction energy of the twinning dislocations on the width of the twin is near-parabolic.     

Surface energy and modes of catalytic growth of semiconductor nanowhiskers

A thermodynamic theory of the growth of semiconductor nanowhisker (NW) crystals according to the vapor-liquid-solid (VLS) mechanism has been developed. An expression is proposed for the effective surface energy of the system, which is considered as a function of the NW radius and the contact angle of a liquid catalyst drop. Minimization of the surface energy leads to two possible modes of the VLS growth. In a standard mode that is realized when the Nebolsin-Shchetinin-Glas (NSC) condition is valid, the drop is not wetting the side surface of the NW. In the opposite case, the growth proceeds in a wetting mode, whereby the drop spreads about the NW top. It is shown for the first time that, even when the NSC condition is valid, the effective surface energy has two minima separated by a barrier and the minimum corresponding to the wetting mode is lower than that for the non-wetting mode. The results are applied to an analysis of the polytypism observed for GaAs nanowhiskers grown with Au and Ga catalysts.     

Influence of Hydrogen on the Equilibrium of a Dislocation Submicrocrack in α-Iron

Numerical methods are used to analyze the influence of hydrogen on the fracture of steels with bcc lattice by the mechanism of microcleavage. The behavior of submicrocracks at the head of a dislocation pileup is studied under uniaxial tension. In the case of delivery of hydrogen by merged dislocations of the pileup into the submicrocrack, it loses stability due to the adsorption decrease in the specific surface energy earlier than it becomes possible under the action of the pressure of hydrogen in the crack. We deduce the dependences of the fracture stress on the specific surface energy and the amount of hydrogen delivered by dislocations into the submicrocrack. The influence of hydrogen condensed on dislocations on the formation of submicrocracks is significant. We establish the relationship between the amount of hydrogen condensed on dislocations, the concentration of diffusing hydrogen in the metal, and rapid degradation of mechanical properties of steel even for small concentrations of dissolved hydrogen.     

单晶硅材料机械性能研究及进展

本文综述了硅材料的机械性能研究进展和相应的研究方法。利用高温拉伸、抗弯测试和显微压痕测试等研究手段 ,指出硅材料表面状况、位错和杂质是其机械性能的主要影响因素。表面损伤将降低硅单晶的拉伸屈服强度和抗弯强度 ;而位错的产生和滑移也可降低单晶的机械性能 ,但杂质对位错的钉扎将起到强化单晶机械性能的作用。     

Continuous plastic cracks in ordered alloys

A discrete dislocation analysis of the continuous plastic crack is carried out for ordered alloys. The crack is assumed to nucleate and reach a size where it will emit a set of lattice dislocations in order to decrease its energy. Further growth of the crack takes place elastically until it can emit the next set of lattice dislocations. Repeated emission of lattice dislocations, with elastic crack growth in between, leads to the Griffith configuration where the energy variation with size of the crack is zero. It is shown that a crack, either tensile or shear, can be stabilized by the presence of antiphase boundary energy alone. In the absence of frictional stress or with the very low frictional stresses encountered in real materials, the lattice dislocations are generated in pairs on each slip plane. However, when the frictional stress is high, the lattice dislocations are generated as single ones, giving rise to an antiphase boundary between the crack and the lattice dislocation.     

Advanced triboelectric materials for liquid energy harvesting and emerging application

Triboelectric properties of materials play an essential role in liquid energy harvesting and emerging application. The triboelectric properties of materials can be controlled by chemical functionalization strategy, which can improve the utilization of liquid energy resources or reduce the hazards of electrostatic effects. Herein, the latest research progress in molecular modification based on chemical functionalization to control triboelectric properties of materials is systematically summarized. By introducing the mechanism of contact electrification between liquid and solid materials and the developmental history of liquid–solid contact electrification, the influence of solid surface charge density, wettability and liquid properties on contact electrification of liquid and solid materials is described. Research progress on chemical functionalization for improving the hydrophobicity of solid materials, surface charge density of solid materials and triboelectric properties of liquid materials is highlighted. The focus then turns to the significance of enhanced liquid–solid contact electrification in energy harvesting, self-powered sensors and metal corrosion protection. Recent advances in chemical functionalization strategies for weakening the triboelectric properties of solid and liquid materials are also highlighted. Finally, an outlook of the potential challenges for developing chemical functionalization strategies in the field of solid surface modification and liquid molecular modification is presented.     

Triboelectric energy harvesting with surface-charge-fixed polymer based on ionic liquid

A novel triboelectric energy harvester has been developed using an ionic liquid polymer with cations fixed at the surface. In this report, the fabrication of the device and the characterization of its energy harvesting performance are detailed. An electrical double layer was induced in the ionic liquid polymer precursor to attract the cations to the surface where they are immobilized using a UV-based crosslinking reaction. The finalized polymer is capable of generating an electrical current when contacted by a metal electrode. Using this property, energy harvesting experiments were conducted by cyclically contacting a gold-surface electrode with the charge fixed surface of the polymer. Control experiments verified the effect of immobilizing the cations at the surface. By synthesizing a polymer with the optimal composition ratio of ionic liquid to macromonomer, an output of 77 nW/cm² was obtained with a load resistance of 1 MΩ at 1 Hz. This tuneable power supply with a μA level current output may contribute to Internet of Things networks requiring numerous sensor nodes at remote places in the environment.     

Stacking fault energy and planar defects on the basal plane in the beta-alumina system

Commercial forms of beta alumina have been examined using transmission electron microscopy. Measurements of the stacking fault energy on the basal plane have been made from the separation of partial dislocations and the equilibrium separation of partials at dislocation nodes, and estimated as 0.6 to 1.65×10^–3 Jm^–2. The structure of two- and three-block beta-alumina has been discussed and their relationship and transformation examined. It has been shown that transformation from two- to three-block beta-alumina cannot be accomplished by a simple shear. Structures generated by the passage of partial dislocations on the glide plane are discussed, and simple twining on the basal plane is examined and shown to be possible in the three-block, but not in the two-block material.     

Correlation between electrokinetic potential, dispersibility, surface chemistry and energy of carbon nanotubes

This paper proposes the correlation between the electrokinetic potential, dispersibility in solvents, surface energy and oxygen content of carbon nanotubes (CNTs) affected by functionalization. Colloidal systems consisting of CNTs with varying degrees of dispersion are prepared and characterized to evaluate CNT dispersibility and suspension stability in solvents with different polarities. The results show that an absolute value of zeta potential at about 25 mV is closely related to the micro- and macroscopic dispersion of CNTs, whereas a high absolute value of 40 mV is regarded as an indication of high quality CNT dispersion with much enhanced suspension stability in solvents. The absolute zeta potential value increases consistently with increasing degree of CNT functionality, the increase being most pronounced in a hydrophilic liquid such as water. A linear correlation is established between the surface energy of a CNT film and the oxygen to carbon ratio of CNT surface. The CNT dispersibility in a liquid is determined not only by their physical states, but also by the hydrophilicity and surface functionality of CNTs, all of which are reflected by zeta potential.     

An energy conservation approach to adsorbate-induced surface stress and the extraction of binding energy using nanomechanics

Surface stress induced by molecular adsorption in three different binding processes has been studied experimentally using a microcantilever sensor. A comprehensive free-energy analysis based on an energy conservation approach is proposed to explain the experimental observations. We show that when guest molecules bind to atoms/molecules on a microcantilever surface, the released binding energy is retained in the host surface, leading to a metastable state where the excess energy on the surface is manifested as an increase in surface stress leading to the bending of the microcantilever. The released binding energy appears to be almost exclusively channeled to the surface energy, and energy distribution to other channels, including heat, appears to be inactive for this micromechanical system. When this excess surface energy is released, the microcantilever relaxes back to the original state, and the relaxation time depends on the particular binding process involved. Such vapor phase experiments were conducted for three binding processes: physisorption, hydrogen bonding, and chemisorption. Binding energies for these three processes were also estimated.     

Energy of a dislocation near an epitaxial interface

The energy of a straight mixed dislocation in a coherent epitaxial layer at a uniform distance t from the interface is calculated. It is shown that, in addition to terms associated with coherency strain and the dislocation energy, there is a term associated with the interaction of the coherency and dislocation strain fields which makes the total energy decrease as the dislocation approaches the interface, but this term is negligible when the dislocation is nearer the epilayer surface than the interface. The result is used to modify a calculation of Jesser and Matthews of the critical thickness of an epitaxial layer at which the introduction of misfit dislocations becomes energetically favourable. The present work reduces the calculated critical thickness by 30–50%.     

位错对高体积分数SiCP/2024Al时效行为的影响

采用粒径为1μm的SiC颗粒,用挤压铸造法制备出体积分数为45 %的SiC_P/2024Al复合材料,研究了位错对高体积分数SiC_P/2024Al时效行为的影响。结果表明,复合材料中的高密度位错可以湮灭大量的淬火空位,这在一定程度上抑制了GP区的析出。但是,高密度位错的存在降低了其它析出相的热扩散激活能,促进了析出相形核;还能为原子的管道扩散提供通道,促进了溶质原子的扩散,加速析出相的长大,在宏观上表现为对时效行为的促进,使峰时效提前。高密度的位错为强烈依赖于位错等缺陷形核的θ'和S'相提供许多优先形核的场所,使复合材料中的形核密度增加,同时使析出相的尺寸减小,所以复合材料中的析出相呈现细小弥散的分布特点。      

The relationship between cracks,holes and surface dislocations

International Journal of Fracture - It has been shown that surface cracks as well as holes can be represented in terms of surface dislocations. These surface dislocations exist in order to insure...     

Structural characterization of high temperature AlN intermediate layer in GaN grown by molecular beam epitaxy

Transmission electron microscopy has been used to study the structural quality of GaN grown on sapphire by plasma assisted molecular beam epitaxy using high temperature AlN intermediate layers with different thicknesses. The introduction of an AlN intermediate layer with an optimum thickness is observed to minimize the density of dislocations reaching the overgrown GaN surface. In this sample, the measured threading dislocation density reaching the surface of 1×10¹⁰ cm⁻² resulted to be seven times lower than that of a reference sample, without any AlN interlayer. The bending at the GaN/AlN interface and following interactions between dislocations have been observed in cross-sectional transmission electron micrographs. This fact explains the decrease of dislocation density reaching the GaN surface.     

Effect of Laser Shock Peening on the Microstructures and Properties of Oxide‐Dispersion‐Strengthened Austenitic Steels

Oxide‐dispersion‐strengthened (ODS) austenitic steels are promising materials for next‐generation fossil and nuclear energy systems. In this study, laser shock peening (LSP) has been applied to ODS 304 austenitic steels, during which a high density of dislocations, stacking faults, and deformation twins are generated in the near surface of the material due to the interaction of laser‐driven shock waves and the austenitic steel matrix. The dispersion particles impede the propagation of dislocations. The compressive residual stress generated by LSP increases with successive LSP scans and decreases along the depth, with a maximum value of ?369 MPa. The hardness on the surface can be improved by 12% using LSP. In situ transmission electron microscopy (TEM) irradiation studies reveal that dislocations and incoherent twin boundaries induced by LSP serve as effective sinks to annihilate irradiation defects. These findings suggest that LSP can improve the mechanical properties and irradiation resistance of ODS austenitic steels in nuclear reactor environments.

     

Mechanism of formation of 60° and 90° misfit dislocations in semiconductor heterostructures

A proposal is made and experimental evidence provided for a mechanism of formation of 60° glissile (a/2)101[111] (mixed) and 90° (a/2)110[001] (edge) misfit dislocations in semiconductor heterostructures such as Ge/Si and GaAs/Si. With increasing thickness of the epilayer the nature of dislocations was found to change from being predominantly 60° to mostly 90°. Calculations of atomic structures of dislocations using Stillinger-Weber interatomic potentials were done to show that it is energetically favorable for a 60° core to transform into a 90° core. Thus the strained layer system relaxes its energy by minimizing short-range core distortions as well as long-range elastic displacements. A distinguishing feature of the present mechanism is that the second 60° dislocation is nucleated near the surface in the appropriate glide plane to meet (primarily via a glide process and partly by a climb process) and react with the first 60° dislocation which is already at the interface. High resolution transmission electron microscopy studies have been performed to rationalize and confirm the proposed mechanism.     

Stress and strain energy of a periodic array of interfacial wedge disclination dipoles in a transversely isotropic bicrystal

Analytical closed-form solutions are obtained for the elastic stress and strain energy density fields of a periodic array of interfacial wedge disclination dipoles in a bicrystal. The adjoining crystals are transversely isotropic with maximum dissimilar in-plane crystallographic orientations (0 and π/2). The solutions are obtained by the method of image dislocations. The strain energy per unit area of the bicrystal interface is also obtained numerically. The results show that significant discrepancies can exist between the bicrystal and the isotropic homogeneous solutions. The rates of decrease/increase of the strain energy density and stresses from the interface are smaller in the crystal whose larger stiffness direction is perpendicular to the interface. Also, the strain energy of the bicrystal boundary is a function of the dipole arm length (2a) and period (L). The maximum strain energy occurs at a/L=0.25 and is estimated to be ∼8.9 J/m² if the dipole period is 10 nm and the disclination strength is π/2.     

The equivalency of surface tension,surface energy and surface free energy

In much of the available literature, there is confusion regarding the correct use of the terms surface tension, surface energy and surface free energy. As a result, these three terms have been used interchangeably to describe the same quantity. This problem is particularly serious in the area of solid surface science. Linford has examined and discussed such inconsistencies but failed to differentiate the three quantities clearly. In the present paper, the definitions and the relationships between surface tension, surface energy and surface free energy are examined and their proper usage clarified.