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At least 631 records · Page 35

Assessment of uncertainty in the numerical simulation of solar irradiance over inclined PV panels: New algorithms using measurements and modeling tools

Development of accurate transposition models to simulate plane-of-array (POA) irradiance from horizontal measurements or simulations is a complex process mainly because of the anisotropic distribution of diffuse solar radiation in the atmosphere. The limited availability of reliable POA measurements at large temporal and spatial scales leads to difficulties in the comprehensive evaluation of transposition models. This paper proposes new algorithms to assess the uncertainty of transposition models using both surface-based observations and modeling tools. We reviewed the analytical derivation of POA irradiance and the approximation of isotropic diffuse radiation that simplifies the computation. Two transposition models are evaluated against the computation by the rigorous analytical solution. We proposed a new algorithm to evaluate transposition models using the clear-sky measurements at the National Renewable Energy Laboratory's (NREL's) Solar Radiation Research Laboratory (SRRL) and a radiative transfer model that integrates diffuse radiances of various sky-viewing angles. We found that the radiative transfer model and a transposition model based on empirical regressions are superior to the isotropic models when compared to measurements. We further compared the radiative transfer model to the transposition models under an extensive range of idealized conditions. Our results suggest that the empirical transposition model has slightly higher cloudy-sky POA irradiance than the radiative transfer model, but performs better than the isotropic models under clear-sky conditions. Significantly smaller POA irradiances computed by the transposition models are observed when the photovoltaics (PV) panel deviates from the azimuthal direction of the sun. The new algorithms developed in the current study have opened the door to a more comprehensive evaluation of transposition models for various atmospheric conditions and solar and PV orientations.

14 SOLAR ENERGY↗

Turbulence characteristics inside a turbulent spot in plane Poiseuille flow

In wall-bounded shear flows the transition to turbulence through localized disturbances goes through a pattern starting with a development of shear layers. The localized normal velocity fluctuations induce normal vorticity through the lift-up effect. These shear layers become unstable to secondary disturbances, and if the amplitudes of the disturbances are large enough, a turbulent spot develops. Investigations of the spot in boundary layers has shown that the turbulent part of the spot is very similar to a fully developed boundary layer. Wygnanski et al. (1976) showed that the mean profile at the center-symmetry plane has a logarithmic region and Johansson et al. (1987) showed that both the higher-order statistics and flow structures in the spot were the same as in the corresponding fully developed flow. In what respects the turbulence inside the Poiseuille spot is similar to fully developed turbulent channel flow is studied. The numerically simulated spot is used, where the characteristics inside the spot are compared to those of the wave packet in the wingtip area. A recent experimental investigation of the velocity field associated with the Poiseuille spot by Klingmann et al. is used for comparison.

Henningson, D. S.↗

Unveiling field-transverse spin anisotropy in the spin liquid candidate α-RuCl3 via spin Hall magnetoresistance

α-RuCl3 has emerged as a possible candidate for a quantum spin liquid (QSL) that promises exotic quasiparticles relevant for fault-tolerant quantum computation. Here, we report spin-sensitive transport measurements using a proximal spin Hall metal, platinum (Pt), to probe magnetic moments in the insulator α-RuCl3. We observe spin Hall magnetoresistance (SMR), where both the transverse and longitudinal resistivities exhibit angular oscillations between the in-plane magnetic field and the current, driven by the interplay between the spin Hall effect in Pt and local magnetic moments in α-RuCl3. These oscillations occur from 1.5 to 18 T, covering the zigzag antiferromagnetic, putative QSL, and supposedly partially field-polarized phases. The phase of the SMR oscillations suggests that the local moments, whether static or fluctuating, develop spin anisotropy with a quantization axis in-plane and largely transverse to the magnetic field across all fields from 1.5 to 18 T. Temperature dependence indicates that the spin anisotropy operates at an energy scale similar to that of the reported QSL signatures in α-RuCl3.

Idzuchi, Hiroshi [Tohoku University, Japan]↗

Joint PP and PS plane-wave wave-equation migration-velocity analysis

Conventional joint PP and PS velocity analysis is based on ray tomography. We develop a joint PP and PS wave-equation migration-velocity-analysis method using plane-wave common-image gathers (CIGs) to produce accurate P- and S-wave velocity models. The objective function of our new method consists of three terms: The first and second terms penalize the moveout residuals computed from PP and PS plane-wave CIGs, respectively, and the third term constrains the nonzero relative depth shifts between the PP and PS migration images. The moveout of plane-wave CIGs is automatically picked using a semblance analysis method, and the relative depth shifts between the PP and PS images are automatically computed using dynamic warping or manually picking the depths of certain primary reflectors. The moveout residuals and the relative depth shifts are transformed into weighted image perturbations, and they are then projected into the velocity models to update the P- and S-wave velocity models using the scalar-wave equations and their linearized forms. Here, numerical tests with synthetic and multicomponent field data demonstrate that our method can simultaneously invert for accurate P- and S-wave velocity models for elastic migration.

58 GEOSCIENCES↗

Turbulent plane Couette flow using probability distribution functions

A numerical scheme employing a combination of the discrete ordinate method and finite differences is developed for solving the one-dimensional form of Lundgren's (1967) model equation for turbulent plane Couette flow. The approach used requires no a priori assumption about the form of the turbulent distribution function, and the numerical solution is obtained directly from the governing differential equations. Two different types of boundary conditions (zero-gradient and Chapman-Enskog) for the distribution function are evaluated by comparing the numerical results with experimental data. It is found that: (1) the present approach gives convergent and stable results over a wide range of Reynolds numbers; (2) Lundgren's equation yields results that compare well with experimental data for mean velocity and skin friction in the case of simple Couette flow; (3) the zero-gradient boundary condition leads to a logarithmic flow profile; and (4) the Chapman-Enskog boundary condition provides very good agreement with experimental data when applied within the near-wall region.

Srinivasan, R.↗

Ab initio electronic structure of quasi-two-dimensional materials: A “native” Gaussian–plane wave approach

Ab initio electronic structure calculations of two-dimensional layered structures are typically performed using codes that were developed for three-dimensional structures, which are periodic in all three directions. The introduction of a periodicity in the third direction (perpendicular to the layer) is completely artificial and may lead in some cases to spurious results and to difficulties in treating the action of external fields. In this paper we develop a new approach, which is “native” to quasi-2D materials, making use of basis function that are periodic in the plane, but atomic-like in the perpendicular direction. We show how some of the basic tools of ab initio electronic structure theory — density functional theory, GW approximation and Bethe-Salpeter equation — are implemented in the new basis. We argue that the new approach will be preferable to the conventional one in treating the peculiarities of layered materials, including the long range of the unscreened Coulomb interaction in insulators, and the effects of strain, corrugations, and external fields.

Trevisanutto, Paolo E.↗

Noncollinear ground states of solids with a source-free exchange correlation functional

In this paper, we expand upon the source-free (SF) exchange correlation (XC) functional developed by Sangeeta Sharma and coworkers to plane-wave density functional theory (DFT) based on the projector augmented wave (PAW) method. This constraint is implemented by the current authors within the VASP source code, using a fast Poisson solver that capitalizes on the parallel three-dimensional fast Fourier transforms (FFTs) implemented in VASP. Using this modified XC functional, we explore the improved convergence behavior that results from applying this constraint to the GGA-PBE+U+J functional. In the process, we compare the noncollinear magnetic ground state computed by each functional and their SF counterpart for a select number of magnetic materials in order to provide a metric for comparing with experimentally determined magnetic orderings. We observe significantly improved agreement with experimentally measured magnetic ground-state structures after applying the source-free constraint. Furthermore, we explore the importance of considering probability current densities in spin-polarized systems, even under no applied field. We analyze the XC torque as well, in order to provide theoretical and computational analyses of the net XC magnetic torque induced by the source-free constraint. Along these lines, we highlight the importance of properly considering the real-space integral of the source-free local magnetic XC field. Our analyses on probability currents, net torque, and constant terms draw additional links to the rich body of previous research on spin-current density functional theory (SCDFT), and pave the way for future extensions and corrections to the SF corrected XC functional.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Analysis of crack closure under plane strain conditions

The phenomenon of plasticity-induced crack closure is associated with the development of residual material on the flanks of an advancing fatigue crack. While it is easy to see that this residual material can come from the side faces of a specimen under plane stress conditions, it is difficult to discover the origin of this extra volume of material on the crack flanks when it is assumed that plane deformations occur and plastic flow is incompressible. The purpose of this paper is to determine whether plasticity-induced fatigue crack closure occurs in an elastic-perfectly plastic body under plane strain conditions.

Fleck, N. A.↗

Analysis of crack closure under plane strain conditions

The phenomenon of plasticity-induced crack closure is associated with the development of residual material on the flanks of an advancing fatigue crack. While it is easy to see that this residual material can come from the side faces of a specimen under plane stress conditions, it is difficult to discover the origin of this extra volume of material on the crack flanks when it is assumed that plane deformations occur and plastic flow is incompressible. The purpose of this paper is to determine whether plasticity-induced fatigue crack closure occurs in an elastic-perfectly plastic body under plane strain conditions.

Fleck, Norman A.↗

Development of a long wavelength spectrometer for the 24-channel multispectral scanner: Instructions for installation, start-up, and adjustment

The basic information is presented, which is required for start-up and operation of two long-wavelength focal-plane and cooler assemblies, including the amplifiers and temperature control systems. The focal plane systems, referred to as the long wavelength spectrometer (LWS) were developed for direct replacement of Arrays 3 and 4 into the multispectral scanner presently being operated by the NASA Manned Spacecraft Center Facility, and Laboratory Support Branch. The equipment is comprised of two major sub-assemblies: Array 3 with three indium antimonide detector channels and Array 4 with seven mercury doped Germanium detector channels. Each array is mounted on a cryogenic cooler and includes the vacuum housings, mounting hardware (x, y, z translation and rotation stages) and detector signal conditioning, temperature control and monitoring electronics. The two arrays were designed to operate independently and do not share common equipment (viz power supplies, housings, mounts, etc.).

Source record↗

Deformation and Transformation Textures in the NaMgF3 Neighborite—Post-Perovskite System

The D″ region of the lower mantle, which lies just above the core–mantle boundary, is distinct from the bulk of the lower mantle in that it exhibits complex seismic heterogeneity and seismic anisotropy. Seismic anisotropy in this region is likely to be largely due to the deformation-induced texture (crystallographic preferred orientation) development of the constituent mineral phases. Thus, seismic anisotropy can provide a marker for deformation processes occurring in this dynamic region of the Earth. Post-perovskite-structured (Mg,Fe)SiO3 is believed to be the dominant mineral phase in many regions of the D”. As such, understanding deformation mechanisms and texture development in post-perovskite is important for the interpretation of observed seismic anisotropy. Here, we report on high-pressure diamond anvil cell deformation experiments on NaMgF3 neighborite (perovskite structure) and post-perovskite. During deformation, neighborite develops a 100 texture, as has been previously observed, both in NaMgF3 and MgSiO3 perovskite. Upon transformation to the post-perovskite phase, an initial texture of {130} at high angles to compression is observed, indicating that the {100} planes of perovskite become the ~{130} planes of post-perovskite. Further compression results in the development of a shoulder towards (001) in the inverse pole figure. Plasticity modeling using the elasto-viscoplastic self-consistent code shows this texture evolution to be most consistent with deformation on (001)[100] with some contribution of glide on (100)[010] and (001)<110> in NaMgF3 post-perovskite. The transformation and deformation mechanisms observed in this study in the NaMgF3 system are consistent with the behavior generally observed in other perovskite–post-perovskite systems, including the MgSiO3 system. This shows that NaMgF3 is a good analog for the mantle bridgmanite and MgSiO3 post-perovskite.

Geochemistry & Geophysics↗

Object recognition and pose estimation of planar objects from range data

The Extravehicular Activity Helper/Retriever (EVAHR) is a robotic device currently under development at the NASA Johnson Space Center that is designed to fetch objects or to assist in retrieving an astronaut who may have become inadvertently de-tethered. The EVAHR will be required to exhibit a high degree of intelligent autonomous operation and will base much of its reasoning upon information obtained from one or more three-dimensional sensors that it will carry and control. At the highest level of visual cognition and reasoning, the EVAHR will be required to detect objects, recognize them, and estimate their spatial orientation and location. The recognition phase and estimation of spatial pose will depend on the ability of the vision system to reliably extract geometric features of the objects such as whether the surface topologies observed are planar or curved and the spatial relationships between the component surfaces. In order to achieve these tasks, three-dimensional sensing of the operational environment and objects in the environment will therefore be essential. One of the sensors being considered to provide image data for object recognition and pose estimation is a phase-shift laser scanner. The characteristics of the data provided by this scanner have been studied and algorithms have been developed for segmenting range images into planar surfaces, extracting basic features such as surface area, and recognizing the object based on the characteristics of extracted features. Also, an approach has been developed for estimating the spatial orientation and location of the recognized object based on orientations of extracted planes and their intersection points. This paper presents some of the algorithms that have been developed for the purpose of recognizing and estimating the pose of objects as viewed by the laser scanner, and characterizes the desirability and utility of these algorithms within the context of the scanner itself, considering data quality and noise.

Pendleton, Thomas W.↗

1024x1024 Pixel MWIR and LWIR QWIP Focal Plane Arrays and 320x256 MWIR:LWIR Pixel Colocated Simultaneous Dualband QWIP Focal Plane Arrays

Mid-wavelength infrared (MWIR) and long-wavelength infrared (LWIR) 1024x1024 pixel quantum well infrared photodetector (QWIP) focal planes have been demonstrated with excellent imaging performance. The MWIR QWIP detector array has demonstrated a noise equivalent differential temperature (NE(Delta)T) of 17 mK at a 95K operating temperature with f/2.5 optics at 300K background and the LWIR detector array has demonstrated a NE(Delta)T of 13 mK at a 70K operating temperature with the same optical and background conditions as the MWIR detector array after the subtraction of system noise. Both MWIR and LWIR focal planes have shown background limited performance (BLIP) at 90K and 70K operating-temperatures respectively, with similar optical and background conditions. In addition, we are in the process of developing MWIR and LWIR pixel collocated simultaneously readable dualband QWIP focal plane arrays.

quantum wells↗

Local probing of ferroelectric and ferroelastic switching through stress-mediated piezoelectric spectroscopy

The role of local strains is fundamental to the large effective piezoelectric and ferroelectric response of thin films. Therefore a method to investigate local strain-induced phenomena is imperative. Here, pressure induced domain reorganization is reported in lead zirconate titanate films with composition near the morphotropic phase boundary. An approach is thus demonstrated to simultaneously study the role of applied mechanical pressure on multiple local properties of the film. In particular, the modification of hysteresis loops collected at different tip pressures is consistent with first mostly ferroelastic and then ferroelectric dominated reorientation of domains under increasing applied pressure. The pressure induced domain writing is also investigated through phase field simulations where the applied pressure is generally found to increase the in-plane polarization of the domains with respect to the out-of-plane component, corroborating the experimental observations. The approach developed here has the potential to explore other hysteretic phenomena and phase transitions in a spatially resolved manner with varying local pressure.

36 MATERIALS SCIENCE↗

Slip velocity boundary conditions for the lattice Boltzmann modeling of microchannel flows

Abstract Slip flows in ducts are important in numerous engineering applications, most notably in microchannel flows. Compared to the standard no‐slip Dirichlet condition, the case of slip formulates as a Robin‐type condition for the fluid tangential velocity. Such an increase in mathematical complexity is accompanied by a more challenging numerical transcription. The present work concerns with this topic, addressing the modeling of the slip velocity boundary condition in the lattice Boltzmann method (LBM) applied to steady slow viscous flows inside ducts of nontrivial shapes. As novelty, we extend the newly revised local second‐order boundary (LSOB) Dirichlet fluid flow method [ Philos. Trans. R. Soc. A 378, 20190404 (2020)] to implement the slip velocity condition within the two‐relaxation‐time (TRT) framework. The LSOB follows an in‐node philosophy where its operation principle seeks to explicitly reconstruct the unknown boundary populations in the form of a third‐order accurate Chapman–Enskog expansion, where the wall slip condition is built‐in as a normal Taylor‐type condition. The key point of this approach is that the required first‐ and second‐order momentum derivatives, rather than computed through nonlocal finite difference approximations, are locally determined through a simple local linear algebra procedure, whose formulation is particularly aided by the TRT symmetry argument. To express the obtained derivatives, two approaches are considered, called and , which operate with node and wall variables, respectively. These two formulations are developed to prescribe the physical slip condition over plane and curved walls, including the corners. Their consistency and accuracy characteristics are examined against alternative linkwise strategies to impose the wall slip velocity, such as the kinetic‐based diffusive bounce‐back scheme, the central linear interpolation slip scheme, and the multireflection slip scheme. The several slip schemes are tested over different 3D microchannel configurations, with walls not conforming with the LBM uniform mesh. Numerical tests confirm the advanced accuracy characteristics of the proposed LSOB slip boundary scheme, revealing the added challenge of the wall slip modeling, and that parabolic accuracy is a necessary requirement to reach second‐order accuracy within this problem class.

Silva, Goncalo↗

Concentration-Dependent Transformation Plasticity Effect During Hydrogenation of Technically Pure Titanium Irradiated with an Electron Beam

Using the methods of X-ray diffraction analysis, the concentration-dependent transformation plasticity effect +TPE) is investigated during hydrogenation of the technically pure titanium (VT1-0) irradiated on one side with a low-energy high-current electron beam in a SOLO facility using three 50 μs pulses at the pulse repetition frequency 0.3 s{sup –1} and the beam energy density W = 18 J/cm{sup 2}. Its irradiation is performed in an argon atmosphere at the residual pressure 0.02 Pa. It is found out that the concentration-dependent TPE in the course of hydrogenation is due to the low stability state of the α-Ti crystal lattice formed in the specimen surface layer upon its e-beam irradiation. Relaxation of the elastic plane macrostresses occurs as a result of the development of concentration inhomogeneity of hydrogen or formation of α″-Ti and ω-Ti martensitic phases.

36 MATERIALS SCIENCE↗

Prediction of residual stresses in additively manufactured parts using lumped capacitance and classical lamination theory

Several industries are interested in Laser Powder Bed Fusion (L-PBF) Additively Manufactured (AM) metal parts because their designs can be made arbitrarily complex while retaining bulk-type material properties. However, the residual stresses (RS) and distortions caused by the heat gradients inherent to L-PBF processes are detrimental to the structural integrity of the parts and must be taken into consideration during the part design cycle. Predicting the state of stresses in as-built 3D printed parts is a difficult problem that is typically approached with the use of transient thermomechanical Finite Element Models (FEMs). However, the nonlinearities associated with AM processes are difficult to capture in these FEMs without increasing the computational cost of the simulation, limiting their ability to be incorporated into practical design cycles. This work presents a novel analytical framework that combines lumped capacitance nonlinear heat transfer with time dependent classical lamination theory to efficiently and accurately predict RS in as-built L-PBF parts without the need of FEMs. The simulation was compared to Neutron Diffraction (ND) residual strain measurements taken at Oak Ridge National Laboratories (ORNL) as well as Synchrotron X-ray Diffraction (XRD) strain data published by the National Institute of Standards and Technology (NIST). The simulation predictions and the experimental data showed excellent agreement for the in-plane strain directions, and general agreement for the out of plane strain component, highlighting an area where further development can be implemented.

42 ENGINEERING↗

Traction-separation response of bilayer graphene interfaces: The role of an intercalated single atomic layer of water molecules and hydroxyl groups

Molecular dynamics simulations of the normal and shear traction-separation response of dry and wet bilayer graphene interfaces were performed. The influence of a single, atomic layer of water molecules sandwiched between graphene layers and hydroxyl functionalization on one or both layers were investigated. Hydroxyl groups provided a shielding effect during normal separation while favoring stick-slip friction under sliding conditions. The single, atomic layer of water molecules confined between hydrophilic and asymmetric hydrophobic/hydrophilic surfaces was found to ease sliding friction. The mechanisms arose from the balance between the attractive and repulsive graphene/water interactions through bridges of single water molecules between the two surfaces and the structure of the water monolayer under confinement for which an out-of-plane water/water hydrogen bond network could not be developed. The single, atomic layer of water molecules reduced the sliding friction the most when both surfaces were hydrophilic and lowered the sliding friction of the asymmetric hydrophobic/hydrophilic interfaces to that when both surfaces were hydrophobic. An optimal hydroxyl surface coverage of less than 10% may exist for efficient water lubrication, with diminishing effect with increasing number of hydroxyl groups. Finally, the findings offer a design strategy for assembling bilayer graphene interfaces with tailored friction and sliding contact properties.

36 MATERIALS SCIENCE↗