Open Access. Powered by Scholars. Published by Universities.®
- Discipline
-
- Engineering (104)
- Materials Science and Engineering (93)
- Condensed Matter Physics (90)
- Engineering Physics (39)
- Chemistry (32)
-
- Materials Chemistry (31)
- Physical Chemistry (31)
- Applied Mathematics (28)
- Other Applied Mathematics (28)
- Statistical, Nonlinear, and Soft Matter Physics (22)
- Metallurgy (17)
- Mechanical Engineering (8)
- Astrophysics and Astronomy (3)
- Biological and Chemical Physics (3)
- Other Physics (3)
- Atomic, Molecular and Optical Physics (2)
- Computer Sciences (2)
- Applied Statistics (1)
- Biomedical Engineering and Bioengineering (1)
- Chemical Engineering (1)
- Earth Sciences (1)
- Education (1)
- Electrical and Computer Engineering (1)
- Industrial Engineering (1)
- Instructional Media Design (1)
- Molecular, Cellular, and Tissue Engineering (1)
- Numerical Analysis and Scientific Computing (1)
- Operations Research, Systems Engineering and Industrial Engineering (1)
- Keyword
-
- Alloy/materials theory (9)
- Article (6)
- Center for Mechanochemistry and Synthesis of New Materials (5)
- Energy (5)
- Calculation (4)
-
- Electrical resistivity (4)
- Copper (3)
- Density (3)
- Electron densities of states (3)
- Grain boundaries (3)
- Mathematical analysis (3)
- Nickel (3)
- Texture (3)
- Cobalt compounds (2)
- Conformation (2)
- Crystal structure (2)
- Density functional theory (2)
- Elasticity (2)
- Electronic structure (2)
- Fourier transform spectra (2)
- Gluon (2)
- Gold (2)
- Hadron (2)
- Heat capacity (2)
- Hydrostatics (2)
- Infrared spectra (2)
- Manganese compounds (2)
- Mathematical model (2)
- Model (2)
- Nickel compounds (2)
- Publication Year
Articles 1 - 30 of 160
Full-Text Articles in Physics
Understanding Student Pathways In Context-Rich Problems, Pavlo Antonenko, John Jackman, Piyamart Kumsaikaew, Rahul Marathe, Dale Niederhauser, Craig Ogilvie, Sarah Ryan
Understanding Student Pathways In Context-Rich Problems, Pavlo Antonenko, John Jackman, Piyamart Kumsaikaew, Rahul Marathe, Dale Niederhauser, Craig Ogilvie, Sarah Ryan
Sarah M. Ryan
In this paper we investigate the ways that students' problem-solving behaviors evolve when solving multi-faceted, context-rich problems within a structured, computer-based learning environment. During the semester, groups of two or three students worked on several problems that required drawing on more than one concept and, hence, could not be readily solved with simple "plug-and-chug" strategies. The problems were presented to students in a data-rich, online problem-solving environment that tracked which information items were selected by students as they attempted to solve the problem. The students also completed a variety of tasks, like entering an initial qualitative analysis into an online …
Opinion Formation On Adaptive Networks With Intensive Average Degree, Beate Schmittmann, Abhishek Mukhopadhyay
Opinion Formation On Adaptive Networks With Intensive Average Degree, Beate Schmittmann, Abhishek Mukhopadhyay
Beate Schmittmann
We study the evolution of binary opinions on a simple adaptive network of N nodes. At each time step, a randomly selected node updates its state (“opinion”) according to the majority opinion of the nodes that it is linked to; subsequently, all links are reassigned with probability p̃ (q̃ ) if they connect nodes with equal (opposite) opinions. In contrast to earlier work, we ensure that the average connectivity (“degree”) of each node is independent of the system size (“intensive”), by choosing p̃ and q̃ to be of O(1/N). Using simulations and analytic arguments, we determine the final steady states …
Structural, Magnetic, And Defect Properties Of Co-Pt-Type Magnetic-Storage Alloys: Density-Functional Theory Study Of Thermal Processing Effects, Aftab Alam, Brent Kraczek, Duane D. Johnson
Structural, Magnetic, And Defect Properties Of Co-Pt-Type Magnetic-Storage Alloys: Density-Functional Theory Study Of Thermal Processing Effects, Aftab Alam, Brent Kraczek, Duane D. Johnson
Duane D. Johnson
Using an optimized-basis Korringa-Kohn-Rostoker-coherent-potential approximation method, we calculate formation enthalpies ΔEf, structural, and magnetic properties of paramagnetic (PM) and ferromagnetic, disordered A1 and ordered L10 CoPt, FePd, and FePt systems that are of interest for high-density magnetic-recording media. To address processing effects, we focus on the point defects that dictate thermal properties and planar defects (e.g., c domain and antiphase boundaries) which can serve as pinning centers for magnetic domains and affect storage properties. We determine bulk Curie (Tc) and order-disorder (To-d) transition temperatures within 4% of observed values, and estimates for nanoparticles. Planar-defect energies γhklx show that the favorable …
Preparation And Characterization Of Pt/Γ-Al2o3 Model Catalyst On Nial Alloy, Zhongfan Zhang, Long Li, Lin-Lin Wang, Sergio I. Sanchez, Ross V. Grieshaber, Qi Wang, Duane D. Johnson, Anatoly I. Frenkel, Ralph G. Nuzzo, Judith C. Yang
Preparation And Characterization Of Pt/Γ-Al2o3 Model Catalyst On Nial Alloy, Zhongfan Zhang, Long Li, Lin-Lin Wang, Sergio I. Sanchez, Ross V. Grieshaber, Qi Wang, Duane D. Johnson, Anatoly I. Frenkel, Ralph G. Nuzzo, Judith C. Yang
Duane D. Johnson
Numerous studies of heterogeneous catalysis systems clearly demonstrate that the metal nanoparticle (NPs)/support interaction is significant in determining the catalytic chemistry. Theoretical simulations have been performed to understand the metal/support interactions [1,2]. For example, theorists discovered that electronic and oxygen defects of γ-Al2O3 anchor the active particles [1]. Platinum NPs dispersed on γ-alumina is one of the most widely used heterogeneous catalysts and Pt performs extremely well as a catalyst for the oxygen-reduction reaction used in fuel cell industries. Hence, we chose Pt/γ-Al2O3 as a model heterogeneous catalyst system to investigate the metal NPs/support interface by electron microscopy methods with …
Interphase Energies Of Hcp Precipitates In Fcc Metals: A Density-Functional Theory Study In Al-Ag, Daniel Finkenstadt, Duane D. Johnson
Interphase Energies Of Hcp Precipitates In Fcc Metals: A Density-Functional Theory Study In Al-Ag, Daniel Finkenstadt, Duane D. Johnson
Duane D. Johnson
Density-functional theory (DFT) calculations of interphase boundary energies relevant to hexagonal-close-packed (hcp) γ-precipitate formation were performed within approximate unit cells that mirror the experimental conditions in face-centered-cubic (fcc) Al-Ag solid solutions. In Al-rich, fcc Al-Ag, γ precipitates are observed to form rapidly with large (300+) aspect ratios even though the Al stacking-fault energy is high (approximately 130 mJ/m2), which should suppress hcp ribbon formation according to standard arguments. Our DFT results show why high-aspect ratio plates occur and why previous estimates based on Wulff construction were orders of magnitude less than observed values. Using DFT, we obtain a Gibbs free-energy …
Analysis Of Nonequilibrium Hcp Precipitate Growth In Fcc Matrices: Application To Al–Ag, Daniel Finkenstadt, Duane D. Johnson
Analysis Of Nonequilibrium Hcp Precipitate Growth In Fcc Matrices: Application To Al–Ag, Daniel Finkenstadt, Duane D. Johnson
Duane D. Johnson
Hexagonal-close-packed (hcp) γ-precipitates with large aspect ratios form rapidly in some face-centered cubic (fcc) solid-solutions. No model explains the observed time-dependent increase in aspect ratio, nor irregular intermediate growth shapes. We propose a nonequilibrium process involving trapezoidal offshoots (controlled only by energetics) that governs the growth behavior (kinetics) and yields nonequilibrium structures in agreement with observation. Then, combining nucleation theory and diffusion-limited growth both of secondary nuclei and ledges, we derive a general growth equation for γ-precipitates due to solute-segregation to precipitate–matrix interfaces that includes our modification of the Jones–Trivedi model for thickening to account for the slow growth of …
Competition Between Multiple Totally Asymmetric Simple Exclusion Processes For A Finite Pool Of Resources, L. Jonathan Cook, R. K. P. Zia, Beate Schmittmann
Competition Between Multiple Totally Asymmetric Simple Exclusion Processes For A Finite Pool Of Resources, L. Jonathan Cook, R. K. P. Zia, Beate Schmittmann
Beate Schmittmann
Using Monte Carlo simulations and a domain-wall theory, we discuss the effect of coupling several totally asymmetric simple exclusion processes (TASEPs) to a finite reservoir of particles. This simple model mimics directed biological transport processes in the presence of finite resources such as protein synthesis limited by a finite pool of ribosomes. If all TASEPs have equal length, we find behavior which is analogous to a single TASEP coupled to a finite pool. For the more generic case of chains with different lengths, several unanticipated regimes emerge. A generalized domain-wall theory captures our findings in good agreement with simulation results.
Optimal Site-Centered Electronic Structure Basis Set From A Displaced-Center Expansion: Improved Results Via A Priori Estimates Of Saddle Points In The Density, Aftab Alam, Duane D. Johnson
Optimal Site-Centered Electronic Structure Basis Set From A Displaced-Center Expansion: Improved Results Via A Priori Estimates Of Saddle Points In The Density, Aftab Alam, Duane D. Johnson
Duane D. Johnson
Site-centered, electronic-structure methods use an expansion inside nonoverlapping “muffin-tin” (MT) spheres plus an interstitial basis set. As the boundary separating the more spherical from nonspherical density between atoms, the “saddle-point” radii (SPR) in the density provide an optimal spherical region for expanding in spherical harmonics, as used in augmented plane wave, muffin-tin orbital, and multiple-scattering [Korringa, Kohn, and Rostoker (KKR)] methods. These MT-SPR guarantee unique, convex Voronoi polyhedra at each site, in distinction to Bader topological cells. We present a numerically fast, two-center expansion to find SPR a priori from overlapping atomic charge densities, valid also for disordered alloys. We …
Surface Geometry Of C60 On Ag(111), H. I. Li, K. Pussi, K. J. Hanna, Lin-Lin Wang, Duane D. Johnson, H.-P. Cheng, H. Shin, S. Curtarolo, W. Moritz, J. A. Smerdon, R. Mcgrath, R. D. Diehl
Surface Geometry Of C60 On Ag(111), H. I. Li, K. Pussi, K. J. Hanna, Lin-Lin Wang, Duane D. Johnson, H.-P. Cheng, H. Shin, S. Curtarolo, W. Moritz, J. A. Smerdon, R. Mcgrath, R. D. Diehl
Duane D. Johnson
The geometry of adsorbed C60 influences its collective properties. We report the first dynamical low-energy electron diffraction study to determine the geometry of a C60 monolayer, Ag(111)−(23√×23√)30°−C60, and related density functional theory calculations. The stable monolayer has C60 molecules in vacancies that result from the displacement of surface atoms. C60 bonds with hexagons down, with their mirror planes parallel to that of the substrate. The results indicate that vacancy structures are the rule rather than the exception for C60 monolayers on close-packed metal surfaces.
Quantitative Prediction Of Twinning Stress In Fcc Alloys: Application To Cu-Al, Sandeep A. Kibey, Lin-Lin Wang, J. B. Liu, H. T. Johnson, H. Sehitoglu, Duane D. Johnson
Quantitative Prediction Of Twinning Stress In Fcc Alloys: Application To Cu-Al, Sandeep A. Kibey, Lin-Lin Wang, J. B. Liu, H. T. Johnson, H. Sehitoglu, Duane D. Johnson
Duane D. Johnson
Twinning is one of most prevalent deformation mechanisms in materials. Having established a quantitative theory to predict onset twinning stress τcrit in fcc elemental metals from their generalized planar-fault-energy (GPFE) surface, we exemplify its use in alloys where the Suzuki effect (i.e., solute energetically favors residing at and near planar faults) is operative; specifically, we apply it in Cu-xAl (x is 0, 5, and 8.3 at. %) in comparison with experimental data. We compute the GPFE via density-functional theory, and we predict the solute dependence of the GPFE and τcrit, in agreement with measured values. We show that τcrit correlates …
Opinion Dynamics On An Adaptive Random Network, I. J. Benczik, S. Z. Benczik, Beate Schmittmann, R. K. P. Zia
Opinion Dynamics On An Adaptive Random Network, I. J. Benczik, S. Z. Benczik, Beate Schmittmann, R. K. P. Zia
Beate Schmittmann
We revisit the classical model for voter dynamics in a two-party system with two basic modifications. In contrast to the original voter model studied in regular lattices, we implement the opinion formation process in a random network of agents in which interactions are no longer restricted by geographical distance. In addition, we incorporate the rapidly changing nature of the interpersonal relations in the model. At each time step, agents can update their relationships. This update is determined by their own opinion, and by their preference to make connections with individuals sharing the same opinion, or rather with opponents. In this …
Bcc-To-Hcp Transformation Pathways For Iron Versus Hydrostatic Pressure: Coupled Shuffle And Shear Modes, J. B. Liu, Duane D. Johnson
Bcc-To-Hcp Transformation Pathways For Iron Versus Hydrostatic Pressure: Coupled Shuffle And Shear Modes, J. B. Liu, Duane D. Johnson
Duane D. Johnson
Using density-functional theory, we calculate the potential-energy surface (PES), minimum-energy pathway (MEP), and transition state (TS) versus hydrostatic pressure σhyd for the reconstructive transformation in Fe from body-centered cubic (bcc) to hexagonal closed-packed (hcp). At fixed σhyd, the PES is described by coupled shear (ϵ) and shuffle (η) modes and is determined from structurally minimized hcp-bcc energy differences at a set of (η,ϵ). We fit the PES using symmetry-adapted polynomials, permitting the MEP to be found analytically. The MEP is continuous and fully explains the transformation and its associated magnetization and volume discontinuity at TS. We show that σhyd (while …
Low-Energy Antiphase Boundaries, Degenerate Superstructures, And Phase Stability In Frustrated Fcc Ising Model And Ag-Au Alloys, Nikolai A. Zarkevich, Teck L. Tan, Lin-Lin Wang, Duane D. Johnson
Low-Energy Antiphase Boundaries, Degenerate Superstructures, And Phase Stability In Frustrated Fcc Ising Model And Ag-Au Alloys, Nikolai A. Zarkevich, Teck L. Tan, Lin-Lin Wang, Duane D. Johnson
Duane D. Johnson
An Ising model exhibits zero-energy antiphase boundaries (APBs) and frustration on close-packed face-centered cubic (fcc) and triangular lattices. The frustration results in degenerate structures and chains of long-period superstructures forming a quasicontinuous ground-state “hull” in the formation energy versus composition (c) diagram. In alloys, a nonzero but small APB energy yields a c-dependent reduction in this degeneracy that affects the phase diagram topology and range of the two-phase coexistence. Using density functional theory combined with cluster expansions (CEs), we study Ag-Au alloys as a prototype and find the effective cluster interactions (dominated by nearest-neighbor pairs), predict energetics of millions of …
Grain Growth And Texture Development In Lithium Fluoride Thin Films, Hakkwan Kim, Alexander H. King
Grain Growth And Texture Development In Lithium Fluoride Thin Films, Hakkwan Kim, Alexander H. King
Alexander H. King
We have studied grain-growth and texture development in polycrystalline lithium fluoride thin films using dark-field transmission electron microscopy. We demonstrate that we can isolate the size distribution of 〈111〉 surface normal grains from the overall size distribution, based on simple and plausible assumptions about the texture. The {111} texture formation and surface morphology were also observed by x-ray diffraction and atomic force microscopy, respectively. The grain-size distributions become clearly bimodal as the annealing time increases, and we deduce that the short-time size distributions are also a sum of two overlapping peaks. The smaller grain-size peak in the distribution corresponds to …
Predicting Enthalpies Of Molecular Substances: Application To Libh4, Nikolai A. Zarkevich, Duane D. Johnson
Predicting Enthalpies Of Molecular Substances: Application To Libh4, Nikolai A. Zarkevich, Duane D. Johnson
Duane D. Johnson
For molecular substances exhibiting harmonic and nonharmonic vibrations, we present a first-principles approach to predict enthalpy differences between phases at finite temperatures, including solid-solid and melting. We apply it to the complex hydride LiBH4. Using ab initio molecular dynamics, we predict a structure for the high-T solid phase of lithium borohydride, and we propose an approximation to account for nonharmonic vibrations. We then predict the enthalpy changes for solid-solid transition, melting, and an H-storage reaction, all in agreement with experiment.
Inhomogeneous Exclusion Processes With Extended Objects: The Effect Of Defect Locations, J. J. Dong, Beate Schmittmann, R. K. P. Zia
Inhomogeneous Exclusion Processes With Extended Objects: The Effect Of Defect Locations, J. J. Dong, Beate Schmittmann, R. K. P. Zia
Beate Schmittmann
We study the effects of local inhomogeneities, i.e., slow sites of hopping rate q<1, in a totally asymmetric simple exclusion process for particles of size ℓ⩾1 (in units of the lattice spacing). We compare the simulation results of ℓ=1 and ℓ>1 and notice that the existence of local defects has qualitatively similar effects on the steady state. We focus on the stationary current as well as the density profiles. If there is only a single slow site in the system, we observe a significant dependence of the current on the location of the slow site for both ℓ=1 and ℓ>1 cases. When two slow sites are introduced, more intriguing phenomena emerge, e.g., dramatic decreases in the current when the two are close together. In addition, …
Posterminaries: More Or Less Modern, Alexander H. King
Posterminaries: More Or Less Modern, Alexander H. King
Alexander H. King
It is yet another sign that I am aging. More and more often when young researchers hand me a written report of their research, I find myself criticizing their introductory section: “You need to start your literature survey with the original papers on this topic. Go and read…” followed by a citation to some classic of the learned literature.
Power Spectra Of The Total Occupancy In The Totally Asymmetric Simple Exclusion Process, D. `A. Adams, R. K. P. Zia, Beate Schmittmann
Power Spectra Of The Total Occupancy In The Totally Asymmetric Simple Exclusion Process, D. `A. Adams, R. K. P. Zia, Beate Schmittmann
Beate Schmittmann
As a solvable and broadly applicable model system, the totally asymmetric exclusion process enjoys iconic status in the theory of nonequilibrium phase transitions. Here, we focus on the time dependence of the total number of particles on a 1-dimensional open lattice and its power spectrum. Using both Monte Carlo simulations and analytic methods, we explore its behavior in different characteristic regimes. In the maximal current phase and on the coexistence line (between high and low density phases), the power spectrum displays algebraic decay, with exponents −1.62 and −2.00, respectively. Deep within the high and low density phases, we find pronounced …
Control Of Porosity In Fluoride Thin Films Prepared By Vapor Deposition, Alexander H. King
Control Of Porosity In Fluoride Thin Films Prepared By Vapor Deposition, Alexander H. King
Alexander H. King
We have measured the porosity in thin films of lithium fluoride (LiF), magnesium fluoride (MgF2), barium fluoride (BaF2), and calcium fluoride (CaF2) as a function of the substrate temperature for films deposited by thermal evaporation onto glass substrates. The amount of porosity in the thin films was measured using an atomic force microscope and a quartz crystal thickness monitor. The porosity was very sensitive to the substrate temperature and decreased as the substrate temperature increased. Consistent behavior was observed among all of the materials in this study.
Posterminaries: Full Circle, Alexander H. King
Posterminaries: Full Circle, Alexander H. King
Alexander H. King
A few years ago, I was walking near the old Union Station in Pittsburgh with a colleague only slightly younger than myself, when we happened upon some large-scale relics of the steel industry displayed for public viewing. “You don’t see too many of those in public parking lots,” I offered. “Um… what is it?” was the response. I suppose I was just a little surprised that a prominent materials scientist did not recognize a Bessemer converter—arguably the principal source of wealth during the U.S. industrial revolution—but this conversation took place back when steel was in decline, and many university Materials …
Controlling Surface Morphologies By Time-Delayed Feedback, M. Block, Beate Schmittmann, E. Schöll
Controlling Surface Morphologies By Time-Delayed Feedback, M. Block, Beate Schmittmann, E. Schöll
Beate Schmittmann
We propose a method to control the roughness of a growing surface via a time-delayed feedback scheme. The method is very general and can be applied to a wide range of nonequilibrium growth phenomena, from solid-state epitaxy to tumor growth. Possible experimental realizations are suggested. As an illustration, we consider the Kardar-Parisi-Zhang equation [Phys. Rev. Lett. 56, 889 (1986)] in 1+1 dimensions and show that the effective growth exponent of the surface width can be stabilized at any desired value in the interval [0.25, 0.33], for a significant length of time.
Density Functional Study Of Structural Trends For Late-Transition-Metal 13-Atom Clusters, Lin-Lin Wang, Duane D. Johnson
Density Functional Study Of Structural Trends For Late-Transition-Metal 13-Atom Clusters, Lin-Lin Wang, Duane D. Johnson
Duane D. Johnson
Because reactivity increases as particle size decreases and competition between numerous structures are possible, which affects catalytic and magnetic properties, we study the structural trends of late-transition-metal 13-atom clusters using density functional theory within the generalized gradient approximation to exchange-correlation functional. We consider open structural motifs, such as bilayer and cubic (recently found to have lower energy), and find new bilayer candidates that are even lower in energy. To study the influence of d-orbital filling on structural trends, we focus on Pt, Pd, and Rh clusters and find several new, low-energy structures for Pt13 and Pd13 from searches using a …
Coarsening Of “Clouds” And Dynamic Scaling In A Far-From-Equilibrium Model System, D. A. Adams, Beate Schmittmann, R. K. P. Zia
Coarsening Of “Clouds” And Dynamic Scaling In A Far-From-Equilibrium Model System, D. A. Adams, Beate Schmittmann, R. K. P. Zia
Beate Schmittmann
A two-dimensional lattice gas of two species, driven in opposite directions by an external force, undergoes a jamming transition if the filling fraction is sufficiently high. Using Monte Carlo simulations, we investigate the growth of these jams (‘‘clouds’’), as the system approaches a nonequilibrium steady state from a disordered initial state. We monitor the dynamic structure factor S(kx,ky;t) and find that the kx=0 component exhibits dynamic scaling, of the form S(0,ky;t)=tβS̃ (kytα). Over a significant range of times, we observe excellent data collapse with α=1/2 and β=1. The effects of varying filling fraction and driving force are discussed.
Interface Reorientation During Coherent Phase Transformations, Valery I. Levitas, I. B. Ozsoy, D. L. Preston
Interface Reorientation During Coherent Phase Transformations, Valery I. Levitas, I. B. Ozsoy, D. L. Preston
Valery I. Levitas
The universal thermodynamic driving force for coherent plane interface reorientation (IR) during first-order phase transformations (PT) in solids is derived. The relation between the rates of IR and interface propagation (IP) and the corresponding driving forces are derived for combined athermal and drag interface friction. The coupled evolution of IR and IP during cubic-tetragonal and tetragonal-orthorhombic PTs under three-dimensional loading is studied. An instability in the interface orientation is shown to have the features of a first-order PT.
First-Principles Prediction Of Phase-Segregating Alloy Phase Diagrams And A Rapid Design Estimate Of Their Transition Temperatures, Nikolai A. Zarkevich, Teck L. Tan, Duane D. Johnson
First-Principles Prediction Of Phase-Segregating Alloy Phase Diagrams And A Rapid Design Estimate Of Their Transition Temperatures, Nikolai A. Zarkevich, Teck L. Tan, Duane D. Johnson
Nikolai A. Zarkevich
We calculate the transition temperature versus concentration (Tc vs c) phase diagrams of several phase-segregating alloys [fcc Ca-Sr, Au-Pt, and Rh-(Pd,Cu,Ag,Au)] using a multiscale method combining first-principles calculations and Monte Carlo via the cluster expansion (CE). We study Pd-Rh, with its well-known high-T miscibility gap, to verify the method’s reliability. We predict that Ca-Sr segregates at low temperatures. We then show that a rapid estimate of Tc is obtained from enthalpies analytically derived from a CE, and, using thermodynamic integration, we determine under what circumstances this mean-field estimate is accurate compared to Monte Carlo results. Also, we discuss how an …
Thermal Effects On Mechanical Grinding-Induced Surface Texture In Tetragonal Piezoelectrics, Wonyoung Chang, Alexander H. King, Keith J. Bowman
Thermal Effects On Mechanical Grinding-Induced Surface Texture In Tetragonal Piezoelectrics, Wonyoung Chang, Alexander H. King, Keith J. Bowman
Alexander H. King
The effect of temperature on grinding-induced texture in tetragonal lead zirconate titanate (PZT) and lead titanate (PT) has been investigated using in situ x-ray diffraction (XRD) with an area detector. In contrast with previous results on electrical poling, mechanically-ground PT and soft PZT materials retain strong ferroelastic textures during thermal cycling, even after excursions to temperatures slightly above the Curie temperature. The relationship between the residual stresses in the surface region, caused by grinding, and those resulting from domain wall motion is elucidated by in situ texture measurements obtained during thermal cycling.
How Surface Stresses Lead To Size-Dependent Mechanics Of Tensile Deformation In Nanowires, M. Ravi Shankar, Alexander H. King
How Surface Stresses Lead To Size-Dependent Mechanics Of Tensile Deformation In Nanowires, M. Ravi Shankar, Alexander H. King
Alexander H. King
It has been proposed that surface and interface stresses can modify the elastic behavior in nanomaterials such as nanowires. The authors show that surface stresses modify the tensile response of nanowires only when nonlinear elastic effects become important leading to cross terms between the applied stress and the surface stress. These effects are only significant when the radius of the nanowire is of the order of a few nanometers. The resulting alteration of tensile stiffness, though effected in part by the nonlinear elastic modulus, is particularly wrought by a modification of the stress state in the deformed nanowire.
Energy Pathways And Directionality In Deformation Twinning, S. Kibey, J. B. Liu, Duane D. Johnson, H. Sehitoglu
Energy Pathways And Directionality In Deformation Twinning, S. Kibey, J. B. Liu, Duane D. Johnson, H. Sehitoglu
Duane D. Johnson
We present ab initiodensity functional theory calculations of twinning energy pathways for two opposite twinning modes, (111)[112¯] and (111)[1¯1¯2], in fcc materials to examine the directional nature of twinning which cannot be explained by classical twin nucleationmodels or the “twinnability” criterion. By accounting for these energy pathways in a multiscale model, we quantitatively predict the critical twinning stress for the (111)[1¯1¯2] mode to be substantially higher compared to the favorable (111)[112¯] mode (whose predicted stresses are in agreement with experiment), thus, ruling out twinning in the (111)[1¯1¯2] mode.
Markov Chain Monte Carlo Defect Identification In Nde Images, Aleksandar Dogandžić, Benhong Zhang
Markov Chain Monte Carlo Defect Identification In Nde Images, Aleksandar Dogandžić, Benhong Zhang
Aleksandar Dogandžić
We derive a hierarchical Bayesian method for identifying elliptically‐shaped regions with elevated signal levels in NDE images. We adopt a simple elliptical parametric model for the shape of the defect region and assume that the defect signals within this region are random following a truncated Gaussian distribution. Our truncated‐Gaussian model ensures that the signals within the defect region are higher than the baseline level corresponding to the noise‐only case. We derive a closed‐form expression for the kernel of the posterior probability distribution of the location, shape, and defect‐signal distribution parameters (model parameters). This result is then used to develop Markov …
Posterminaries: After Nabarro, Alexander H. King
Posterminaries: After Nabarro, Alexander H. King
Alexander H. King
With the passing of Frank Nabarro in July of this year, we have lost one of the founding fathers of materials science. His name appears in many of the textbooks from which we train our students today, and also on the spines of several volumes on dislocation theory, including his classic monograph on the subject. He rightly stands among the gods of our field. Ninety years old at his death, he was a sprightly dancer at the frontiers of knowledge, right up to the end.