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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 1,495 records · Page 83
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

Atomistic modeling of structure II gas hydrate mechanics: Compressibility and equations of state

This work uses density functional theory (DFT) to investigate the poorly characterized structure II gas hydrates, for various guests (empty, propane, butane, ethane-methane, propane-methane), at the atomistic scale to determine key structure and mechanical properties such as equilibrium lattice volume and bulk modulus. Several equations of state (EOS) for solids (Murnaghan, Birch-Murnaghan, Vinet, Liu) were fitted to energy-volume curves resulting from structure optimization simulations. These EOS, which can be used to characterize the compressional behaviour of gas hydrates, were evaluated in terms of their robustness. The three-parameter Vinet EOS was found to perform just as well if not better than the four-parameter Liu EOS, over the pressure range in this study. As expected, the Murnaghan EOS proved to be the least robust. Furthermore, the equilibrium lattice volumes were found to increase with guest size, with double-guest hydrates showing a larger increase than single-guest hydrates, which has significant implications for the widely used van der Waals and Platteeuw thermodynamic model for gas hydrates. Also, hydrogen bonds prove to be the most likely factor contributing to the resistance of gas hydrates to compression; bulk modulus was found to increase linearly with hydrogen bond density, resulting in a relationship that could be used predictively to determine the bulk modulus of various structure II gas hydrates. Taken together, these results fill a long existing gap in the material chemical physics of these important clathrates.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

PARTICLE ACCELERATION AT LOW CORONAL COMPRESSION REGIONS AND SHOCKS

We present a study on particle acceleration in the low corona associated with the expansion and acceleration of coronal mass ejections (CMEs). Because CME expansion regions low in the corona are effective accelerators over a finite spatial region, we show that there is a rigidity regime where particles effectively diffuse away and escape from the acceleration sites using analytic solutions to the Parker transport equation. This leads to the formation of broken power-law distributions. Based on our analytic solutions, we find a natural ordering of the break energy and second power-law slope (above the break energy) as a function of the scattering characteristics. These relations provide testable predictions for the particle acceleration from low in the corona. Our initial analysis of solar energetic particle observations suggests a range of shock compression ratios and rigidity dependencies that give rise to the solar energetic particle (SEP) events studied. The wide range of characteristics inferred suggests competing mechanisms at work in SEP acceleration. Thus, CME expansion and acceleration in the low corona may naturally give rise to rapid particle acceleration and broken power-law distributions in large SEP events.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2021

Energy efficiency of blower heater non-purge compressed air dryers

This research focuses on twin tower regenerative closed loop desiccant dryers, specifically: blower heater non-purge (BHNP) with and without cooling water pumps, compressed-air heater purge (CHP), blower heater purge (BHP) and pressure swing heaterless (PSH). The research was conducted by collecting and analysing real time current draw data on air compressors and associated dryers at eight different facilities (13 air compressors) in terms of energy, power and cost. A decision tool was developed to depict the operational characteristics (power, energy and cost) of each type of dryer if used in conjunction with the selected compressor system. Finally, this research, on an equivalent normalised basis, compared and contrasted the different types of dryers in terms of performance and cost. Here, the research concluded that of the five types of desiccant dryer types observed the most energy efficient was the BHNP (with cooling water pump), subject to the operational conditions.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2023

In Situ Study on Cu-to-Cu Thermal Compression Bonding

Cu-to-Cu thermal compression bonding (TCB) has emerged as a promising solution for ultrafine pitch packaging in 3D integrated circuit technologies. Despite the progress made by conventional Cu-to-Cu TCB methods in achieving good mechanical strength of the Cu bonds, the bonding processes generally require high temperature and high pressure, which may degrade the performance and reliability of the device. Therefore, it is imperative to investigate the processing parameters to understand the bonding mechanism and achieve effective TCB at a low temperature and low pressure. Here, we developed an in situ TCB technique inside a scanning electron microscope. The in situ TCB method enables a real-time observation of bonding development, which provides critical insights into how the texture and microstructure of Cu bumps may influence the creep and surface diffusion during the bonding process. This work features a strategy to advance our understanding of the bonding mechanisms and provides insight into tailoring the microstructure of Cu for bonding at a low temperature and low pressure.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Modeling the Plasma Flow in the Inner Heliosheath with a Spatially Varying Compression Ratio

We examine a semi-analytical non-magnetic model of the termination shock location previously developed by Exarhos and Moussas. In their study, the plasma flow beyond the shock is considered incompressible and irrotational, thus the flow potential is analytically derived from the Laplace equation. Here we examine the characteristics of the downstream flow in the heliosheath in order to resolve several inconsistencies existing in the Exarhos and Moussas model. In particular, the model is modified in order to be consistent with the Rankine–Hugoniot jump conditions and the geometry of the termination shock. It is shown that a shock compression ratio varying along the latitude can lead to physically correct results. We describe the new model and present several simplified examples for a nearly spherical, strong termination shock. Under those simplifications, the upstream plasma is nearly adiabatic for large (∼100 AU) heliosheath thickness.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2017

3D Tunable, Multiscale, and Multistable Vibrational Micro-Platforms Assembled by Compressive Buckling

Microelectromechanical systems remain an area of significant interest in fundamental and applied research due to their wide ranging applications. Most device designs, however, are largely 2D and constrained to only a few simple geometries. Achieving tunable resonant frequencies or broad operational bandwidths requires complex components and/or fabrication processes. The work presented here reports unusual classes of 3D micromechanical systems in the form of vibratory platforms assembled by controlled compressive buckling. Such 3D structures can be fabricated across a broad range of length scales and from various materials, including soft polymers, monocrystalline silicon, and their composites, resulting in a wide scope of achievable resonant frequencies and mechanical behaviors. Platforms designed with multistable mechanical responses and vibrationally decoupled constituent elements offer improved bandwidth and frequency tunability. Furthermore, the resonant frequencies can be controlled through deformations of an underlying elastomeric substrate. Systematic experimental and computational studies include structures with diverse geometries, ranging from tables, cages, rings, ring-crosses, ring-disks, two-floor ribbons, flowers, umbrellas, triple-cantilever platforms, and asymmetric circular helices, to multilayer constructions. These concepts form the foundations for engineering designs that complement those supported by conventional, micro-electromechanical systems, with capabilities that could be useful in systems for biosensing, energy harvesting, and others.

36 MATERIALS SCIENCE↗
DOE OSTI2015

OpenACC acceleration of an unstructured CFD solver based on a reconstructed discontinuous Galerkin method for compressible flows

Here, an OpenACC directive-based graphics processing unit (GPU) parallel scheme is presented for solving the compressible Navier–Stokes equations on 3D hybrid unstructured grids with a third-order reconstructed discontinuous Galerkin method. The developed scheme requires the minimum code intrusion and algorithm alteration for upgrading a legacy solver with the GPU computing capability at very little extra effort in programming, which leads to a unified and portable code development strategy. A face coloring algorithm is adopted to eliminate the memory contention because of the threading of internal and boundary face integrals. A number of flow problems are presented to verify the implementation of the developed scheme. Timing measurements were obtained by running the resulting GPU code on one Nvidia Tesla K20c GPU card (Nvidia Corporation, Santa Clara, CA, USA) and compared with those obtained by running the equivalent Message Passing Interface (MPI) parallel CPU code on a compute node (consisting of two AMD Opteron 6128 eight-core CPUs (Advanced Micro Devices, Inc., Sunnyvale, CA, USA)). Speedup factors of up to 24× and 1.6× for the GPU code were achieved with respect to one and 16 CPU cores, respectively. The numerical results indicate that this OpenACC-based parallel scheme is an effective and extensible approach to port unstructured high-order CFD solvers to GPU computing.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2015

A third-order implicit discontinuous Galerkin method based on a Hermite WENO reconstruction for time-accurate solution of the compressible Navier-Stokes equations

Here, a space and time third-order discontinuous Galerkin method based on a Hermite weighted essentially non-oscillatory reconstruction is presented for the unsteady compressible Euler and Navier–Stokes equations. At each time step, a lower-upper symmetric Gauss–Seidel preconditioned generalized minimal residual solver is used to solve the systems of linear equations arising from an explicit first stage, single diagonal coefficient, diagonally implicit Runge–Kutta time integration scheme. The performance of the developed method is assessed through a variety of unsteady flow problems. Numerical results indicate that this method is able to deliver the designed third-order accuracy of convergence in both space and time, while requiring remarkably less storage than the standard third-order discontinous Galerkin methods, and less computing time than the lower-order discontinous Galerkin methods to achieve the same level of temporal accuracy for computing unsteady flow problems.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2021

On the numerical accuracy in finite-volume methods to accurately capture turbulence in compressible flows

The goal of the present article is to understand the impact of numerical schemes for the reconstruction of data at cell faces in finite-volume methods, and to assess their interaction with the quadrature rule used to compute the average over the cell volume. Here, third-, fifth- and seventh-order WENO-Z schemes are investigated. On a problem with a smooth solution, the theoretical order of convergence rate for each method is retrieved, and changing the order of the reconstruction at cell faces does not impact the results, whereas for a shock-driven problem all the methods collapse to first-order. Here, study of the decay of compressible homogeneous isotropic turbulence reveals that using a high-order quadrature rule to compute the average over a finite-volume cell does not improve the spectral accuracy and that all methods present a second-order convergence rate. However the choice of the numerical method to reconstruct data at cell faces is found to be critical to correctly capture turbulent spectra. In the context of simulations with finite-volume methods of practical flows encountered in engineering applications, it becomes apparent that an efficient strategy is to perform the average integration with a low-order quadrature rule on a fine mesh resolution, whereas high-order schemes should be used to reconstruct data at cell faces.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2016

Global molecular changes in a tibial compression induced ACL rupture model of post-traumatic osteoarthritis

Joint injury causes post-traumatic osteoarthritis (PTOA). About ~ 50% of patients rupturing their anterior cruciate ligament (ACL) will develop PTOA within 1–2 decades of the injury, yet the mechanisms responsible for the development of PTOA after joint injury are not well understood. In this study, we examined whole joint gene expression by RNA sequencing (RNAseq) at 1 day, 1-, 6-, and 12 weeks post injury, in a non-invasive tibial compression (TC) overload mouse model of PTOA that mimics ACL rupture in humans. We identified 1446 genes differentially regulated between injured and contralateral joints. This includes known regulators of osteoarthritis such as MMP3, FN1, and COMP, and several new genes including Suco, Sorcs2, and Medag. We also identified 18 long noncoding RNAs that are differentially expressed in the injured joints. By comparing our data to gene expression data generated using the surgical destabilization of the medial meniscus (DMM) PTOA model, we identified several common genes and shared mechanisms. Our study highlights several differences between these two models and suggests that the TC model may be a more rapidly progressing model of PTOA. This study provides the first account of gene expression changes associated with PTOA development and progression in a TC model.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2016

Effects of Facet Joint Injection Reducing the Need for Percutaneous Vertebroplasty in Vertebral Compression Fractures

ObjectiveTo evaluate the effects of facet joint injection (FJI) reducing the need for percutaneous vertebroplasty (PVP) in cases of vertebral compression fracture (VCF).Materials and MethodsA total of 169 patients who were referred to the radiology department of our institution for PVP between January 2011 and December 2014 were retrospectively evaluated. The effectiveness of FJI was evaluated by the proportion of patients who cancelled PVP and who experienced reduced pain. In addition, by means of medical chart and MRI review, those clinical factors (age, sex, history of trauma, amount of injected steroids and interval days elapsed between VCF and FJI) and MR image factors (kyphosis angle, height loss, single or multiple level of VCF, burst fracture, central canal compromise, posterior element injury) that were believed to be significant for the effectiveness of FJI were statistically analysed.ResultsIn the 26 patients with FJI prior to PVP, six (23 %) patients cancelled PVP with considerable improvement in reported pain. In the 20 patients with PVP after FJI, improvement in pain after FJI was reported by six patients, resulting in a total of 12 patients (46 %) who experienced reduced pain after FJI. Clinical factors and MR image factors did not show any statistically significant difference between those groups, divided by PVP cancellation and by improvement of pain.ConclusionAfter FJI prior to PVP, about one quarter of patients cancelled PVP due to reduced pain and overall about half of the patients experienced reduced pain.

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2018

Lossy Data Compression Effects on Wall-bounded Turbulence: Bounds on Data Reduction

Postprocessing and storage of large data sets represent one of the main computational bottlenecks in computational fluid dynamics. We assume that the accuracy necessary for computation is higher than needed for postprocessing. Therefore, in the current work we assess thresholds for data reduction as required by the most common data analysis tools used in the study of fluid flow phenomena, specifically wall-bounded turbulence. These thresholds are imposed a priori by the user in L 2 -norm, and we assess a set of parameters to identify the minimum accuracy requirements. The method considered in the present work is the discrete Legendre transform (DLT), which we evaluate in the computation of turbulence statistics, spectral analysis and resilience for cases highly-sensitive to the initial conditions. Maximum acceptable compression ratios of the original data have been found to be around 97%, depending on the application purpose. Furthermore, the new method outperforms downsampling, as well as the previously explored data truncation method based on discrete Chebyshev transform (DCT).

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2021

Poisson’s ratio of eTPU molded bead foams in compression via in situ synchrotron X-ray microtomography

In situ synchrotron X-ray microtomography was used to characterize the bulk deformation behavior by computing the Poisson's ratio of expanded thermoplastic polyurethane (eTPU) molded bead foams used in footwear midsole during compression. Quantitative data on morphological characteristics were obtained using an iterative image processing workflow. Image correlation on the 4D datasets using DVC was performed to calculate the volumetric and axial strain to estimate the Poisson ratio. Strain maps from DVC showed the influence of variability in ligament thickness distribution on the global mechanical behavior exhibited which dominated the response seen in these bead foams. Lastly, our results showed a strong correlation between Poisson ratio and distribution of ligament thickness in foams.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Bulk nanocrystalline Al–Mg–Y alloys with amorphous grain boundary complexions display high strength and compressive plasticity

Although nanocrystalline alloys regularly exhibit high strengths, their use in structural applications often face challenges due to sample size limitations, unstable microstructures, and the limited ability to plastically deform. The incorporation of amorphous grain boundary complexions has been proposed to address these issues, by simultaneously stabilizing nanocrystalline grain structures for scale-up processing and improving alloy toughness. In the present study, the mechanical behavior of bulk nanocrystalline Al–Mg–Y is examined with macroscale compression testing, probing a length scale that is relevant to real-world structural applications. Bulk samples were fabricated via a simple powder metallurgy approach, with different hot-pressing temperatures and durations employed for consolidation in order to investigate microstructural and property evolution. All of the specimens contained primary face-centered cubic Al and secondary Al 4 C 3 and Al 3 Y phases, with the Al 3 Y particles exhibiting two populations of small equiaxed and larger elongated particles. Appreciable plasticity was measured along with high ultimate stresses over 800 MPa due to the presence of amorphous grain boundary complexions. Microstructural characterization of fracture surfaces revealed that the area fraction of dimpled regions increased with longer hot-pressing time. Most importantly, the elongated Al 3 Y particles formed regular cellular patterns with increasing hot-pressing time, delaying shear localization and significantly enhancing plasticity. The hierarchy present in the microstructure of the Al–Mg–Y alloy, from amorphous grain boundary complexions to secondary phases, gives rise to excellent bulk mechanical properties, which are attractive for structural applications.

Bulk nanocrystalline alloy↗
DOE OSTI2014

Weighted Non-linear Compact Schemes for the Direct Numerical Simulation of Compressible, Turbulent Flows

A new class of compact-reconstruction weighted essentially non-oscillatory (CRWENO) schemes were introduced (Ghosh and Baeder in SIAM J Sci Comput 34(3): A1678–A1706, 2012) with high spectral resolution and essentially non-oscillatory behavior across discontinuities. The CRWENO schemes use solution-dependent weights to combine lower-order compact interpolation schemes and yield a high-order compact scheme for smooth solutions and a non-oscillatory compact scheme near discontinuities. The new schemes result in lower absolute errors, and improved resolution of discontinuities and smaller length scales, compared to the weighted essentially non-oscillatory (WENO) scheme of the same order of convergence. Several improvements to the smoothness-dependent weights, proposed in the literature in the context of the WENO schemes, address the drawbacks of the original formulation. This paper explores these improvements in the context of the CRWENO schemes and compares the different formulations of the non-linear weights for flow problems with small length scales as well as discontinuities. Simplified one- and two-dimensional inviscid flow problems are solved to demonstrate the numerical properties of the CRWENO schemes and its different formulations. Canonical turbulent flow problems—the decay of isotropic turbulence and the shock-turbulence interaction—are solved to assess the performance of the schemes for the direct numerical simulation of compressible, turbulent flows

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Numerical Modeling of Gas-Liquid Compressible Pipe Flow Based on the Theory of Thermodynamically Compatible Systems

Based on the theory of thermodynamically compatible systems, we formulate the governing equations of a gas-liquid compressible pipe flow and develop the Runge–Kutta–TVD and Runge–Kutta–WENO high accuracy methods. The computational model is used to solve a series of test cases demonstrating its efficiency and capability to be applied to slug flows modeling.

42 ENGINEERING↗
DOE OSTI2018

On the Problem on Slow Entrance of a Flat Piston in Compressed Liquid

In this paper, slow movement of a flat piston in compressed liquid is considered. The solution of the problem is constructed with two different methods: the first is based on the theory of Riemann’s simple waves, and the second on the small parameter method. Then we compare the results obtained by the two methods.

42 ENGINEERING↗