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At least 163 records · Page 9

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NASA NTRS1988

Choice of implicit and explicit operators for the upwind differencing method

The flux-vector and flux-difference splittings of Steger-Warming, Van Leer and Roe are tested in all possible combinations in the implicit and explicit operators that can be distinguished in implicit relaxation methods for the steady Euler and Navier-Stokes equations. The tests include one-dimensional inviscid nozzle flow, and two-dimensional inviscid and viscous shock reflection. Roe's splitting, as anticipated, is found to uniformly yield the most accurate results. On the other hand, an approximate Roe splitting of the implicit operator (the complete Roe splitting is too complicated for practical use) proves to be the least robust with regard to convergence to the steady state. In this respect, the Steger-Warming splitting is the most robust: it leads to convergence when combined with any of the splittings in the explicit operator, although not necessarily in the most efficient way.

Liou, Meng-Sing↗

DOE OSTI2022

Sustainable Conversion of Carbon Dioxide and Shale Gas to Green Acetic Acid via a Thermochemical Cyclic Redox Scheme (Final Report)

The large-scale production of commodity chemicals relies heavily on the combustion of fossil fuels. As a result, enormous amounts of carbon dioxide (CO 2 ) are emitted which severely affects the global climate. The challenges for CO 2 utilization reside in the high stability of CO 2 molecules relative to the products, which requires the addition of significant external energy and overcoming slow and/or unfavorable reaction kinetics/thermodynamics. Chemical looping dry reforming of methane (CLDRM), also known as a hybrid redox process (HRP), is a promising alternative that allows the utilization of CO 2 and domestic shale gas resources to produce commodity chemicals. HRP works in two steps: In the first step, a redox catalyst reacts with methane to yield synthesis gas with a H 2 /CO ratio near 2:1, which is suitable for methanol and Fischer–Tropsch synthesis. The reduced redox catalyst then reacts with an oxidizing agent, such as CO 2 , to yield CO. In comparison to conventional thermochemical CO 2 splitting approaches, the use of methane as the reducing agent in HRP can significantly lower the operating temperature for CO 2 splitting.

03 NATURAL GAS↗

DOE OSTI2024

Earth-catalyzed detection of magnetic inelastic dark matter with photons in large underground detectors

Inelastic dark matter with moderate splittings, $\mathcal{O}$ (few to 150) keV, can upscatter to an excited state in the Earth, with the excited state subsequently decaying, leaving a distinctive monoenergetic photon signal in large underground detectors. The photon signal can exhibit sidereal-daily modulation, providing excellent separation from backgrounds. Using a detailed numerical simulation, we examine this process as a search strategy for magnetic inelastic dark matter with the dark matter mass near the weak scale, where the upscatter to the excited state and decay proceed through the same magnetic dipole transition operator. At lower inelastic splittings, the scattering is dominated by moderate mass elements in the Earth with high spin, especially 27 Al, while at larger splittings, 56 Fe becomes the dominant target. We show that the proposed large volume gaseous detector CYGNUS will have excellent sensitivity to this signal. Xenon detectors also provide excellent sensitivity through the inelastic nuclear recoil signal, and if a future signal is seen, we show that the synergy among both types of detection can provide strong evidence for magnetic inelastic dark matter. In the course we have calculated nuclear response functions for elements relevant for scattering in the Earth, which are publicly available on GitHub.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

NASA NTRS1992

Upwind differencing and LU factorization for chemical non-equilibrium Navier-Stokes equations

By means of either the Roe or the Van Leer flux-splittings for inviscid terms, in conjunction with central differencing for viscous terms in the explicit operator and the Steger-Warming splitting and lower-upper approximate factorization for the implicit operator, the present, robust upwind method for solving the chemical nonequilibrium Navier-Stokes equations yields formulas for finite-volume discretization in general coordinates. Numerical tests in the illustrative cases of a hypersonic blunt body, a ramped duct, divergent nozzle flows, and shock wave/boundary layer interactions, establish the method's efficiency.

Shuen, Jian-Shun↗

DOE OSTI2023

A freely falling graviton in the D1D5 CFT

We study a freely falling graviton propagating in AdS in the context of the D1D5 CFT, where we introduce an interaction by turning on a deformation operator. We start with one left and right moving boson in the CFT. After applying two deformation operators, the initial bosons split into three left moving and three right moving bosons. We compute the amplitude for various energies and extrapolate the result to the large energy region. At early times, the amplitude is linear in time. This corresponds to an infalling graviton becoming redshifted in AdS. At late times, the amplitude is periodic, which agrees with the fact that a freely falling graviton will not be thermalized.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2022

Graphene-Based Quantum Hall Interferometer with Self-Aligned Side Gates

The vanishing band gap of graphene has long presented challenges for fabricating high-quality quantum point contacts (QPCs)–the partially transparent p-n interfaces introduced by conventional split-gates tend to short the QPC. This complication has hindered the fabrication of graphene quantum Hall Fabry-P'erot interferometers, until recent advances have allowed split-gate QPCs to operate utilizing the highly resistive ν = 0 state. Here, we present a simple recipe to fabricate QPCs by etching a narrow trench in the graphene sheet to separate the conducting channel from self-aligned graphene side gates. Finally, we demonstrate operation of the individual QPCs in the quantum Hall regime, and further utilize these QPCs to create and study a quantum Hall interferometer.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

NASA NTRS1976

Split Space-Marching Finite-Volume Method for Chemically Reacting Supersonic Flow

A space-marching finite-volume method employing a nonorthogonal coordinate system and using a split differencing scheme for calculating steady supersonic flow over aerodynamic shapes is presented. It is a second-order-accurate mixed explicit-implicit procedure that solves the inviscid adiabatic and nondiffusive equations for chemically reacting flow in integral conservation-law form. The relationship between the finite-volume and differential forms of the equations is examined and the relative merits of each discussed. The method admits initial Cauchy data situated on any arbitrary surface and integrates them forward along a general curvilinear coordinate, distorting and deforming the surface as it advances. The chemical kinetics term is split from the convective terms which are themselves dimensionally split, thereby freeing the fluid operators from the restricted step size imposed by the chemical reactions and increasing the computational efficiency. The accuracy of this splitting technique is analyzed, a sufficient stability criterion is established, a representative flow computation is discussed, and some comparisons are made with another method.

Rizzi, Arthur W.↗

NASA NTRS2001

On-Orbit Maintenance Operations Strategy for the International Space Station - Concept and Implementation

The International Space Station (ISS) has an operational mission and profile that makes it a Logistics and Maintenance (L&M) support challenge different from previous programs. It is permanently manned, assembled on orbit, and multi-national. With this technical and operational challenge, a unique approach is needed to support the hardware and crew. The key is the integration of on-orbit and ground analysis, supply, maintenance, and crew training into a coherent functional process that supports ISS goals and objectives. To integrate all the necessary aspects of hardware and personnel to support on-orbit maintenance, a myriad of products and processes must be created and coordinated, such that the right resources are in the right place at the right time to ensure continued ISS functionality. This paper will familiarize the audience with ISS On-Orbit Maintenance (OOM) concepts and capabilities for different maintenance tasks and discuss some of the logic behind their selection. It will also identify the operational maintenance support responsibility split between the U.S. and the various International Partners (IPs).

Patterson, Linda P.↗

NASA NTRS1975

A generalized hyperbolic marching method for chemically reacting 3-D supersonic flow using a splitting technique

A generalized hyperbolic marching method employing a nonorthogonal coordinate system and using a split differencing scheme for calculating steady supersonic flow over aerodynamic shapes is presented. It is a second-order-accurate mixed explicit-implicit procedure that solves the inviscid adiabatic and nondiffusive equations for chemically reacting flow in integral conservation-law form. The relationship between the integral and differential forms of the equations are examined and the relative merits of each discussed. The method admits initial Cauchy data situated on any arbitrary surface and integrates them forward along a general curvilinear coordinate, distorting and deforming the surface as it advances. The chemical kinetics term is split from the convective terms which are themselves dimensionally split, thereby freeing the fluid operators from the restricted step-size imposed by the chemical reactions and increasing the computational efficiency. The accuracy of this splitting technique is analyzed, a sufficient stability criterion is established, and comparisons are made with another method.

Rizzi, A. W.↗

NASA NTRS2019

Entropy Stable Method for the Euler Equations Revisited: Central Differencing via Entropy Splitting and SBP

The two decades old high order central differencing via entropy splitting and summation-by-parts (SBP) difference boundary closure of Ols- son & Oliger (1994), Gerritsen & Olsson (1996), and Yee et al. (2000) is revisited. The entropy splitting is a form of skew-symmetric splitting of the nonlinear Euler flux derivatives. Central differencing applied to the entropy splitting form of the Euler flux derivatives together with SBP difference operators will, hereafter, be referred to as entropy split schemes. This study is prompted by the recent growing interest in numerical methods for which a discrete entropy conservation law holds, a discrete global entropy conservation can be proved and/or the numerical method possesses a stable entropy in the framework of SBP difference operators and L2-energy norm estimate. The objective of this paper is to recast the entropy split scheme as the re- cent definition of an entropy stable method for central differencing with SBP operators for both periodic and non-periodic boundary conditions for non- linear Euler equations. Standard high order spatial central differencing as well as high order central spatial DRP (dispersion relation preserving) spatial differencing is part of the entropy stable methodology framework. Long time integration of 2D and 3D test cases is included to show the comparison of this efficient entropy stable method with the Tadmor-type of entropy conservative methods. Studies also include the comparison among the three skew-symmetric splittings on their nonlinear stability and accuracy performance without added numerical dissipations for smooth flows. These are, namely, entropy splitting, Ducros et al. splitting and the Kennedy & Grub- ber splitting.

Sjogreen, Bjorn↗

DOE OSTI2023

HipBone: A performance-portable graphics processing unit-accelerated C++ version of the NekBone benchmark

We present hipBone, an open-source performance-portable proxy application for the Nek5000 (and NekRS) computational fluid dynamics applications. HipBone is a fully GPU-accelerated C++ implementation of the original NekBone CPU proxy application with several novel algorithmic and implementation improvements which optimize its performance on modern fine-grain parallel GPU accelerators. Our optimizations include a conversion to store the degrees of freedom of the problem in assembled form in order to reduce the amount of data moved during the main iteration and a portable implementation of the main Poisson operator kernel. We demonstrate near-roofline performance of the operator kernel on three different modern GPU accelerators from two different vendors. We present a novel algorithm for splitting the application of the Poisson operator on GPUs which aggressively hides MPI communication required for both halo exchange and assembly. Our implementation of nearest-neighbor MPI communication then leverages several different routing algorithms and GPU-Direct RDMA capabilities, when available, which improves scalability of the benchmark. We demonstrate the performance of hipBone on three different clusters housed at Oak Ridge National Laboratory, namely, the Summit supercomputer and the Frontier early-access clusters, Spock and Crusher. Our tests demonstrate both portability across different clusters and very good scaling efficiency, especially on large problems.

Computer Science↗

DOE OSTI2023

Organometal Halide Perovskite‐Based Photoelectrochemical Module Systems for Scalable Unassisted Solar Water Splitting

Despite achievements in the remarkable photoelectrochemical (PEC) performance of photoelectrodes based on organometal halide perovskites (OHPs), the scaling up of small-scale OHP-based PEC systems to large-scale systems remains a great challenge for their practical application in solar water splitting. Significant resistive losses and intrinsic defects are major obstacles to the scaling up of OHP-based PEC systems, leading to the PEC performance degradation of large-scale OHP photoelectrodes. Herein, a scalable design of the OHP-based PEC systems by modularization of the optimized OHP photoelectrodes exhibiting a high solar-to-hydrogen conversion efficiency of 10.4% is suggested. As a proof-of-concept, the OHP-based PEC module achieves an optimal PEC performance by avoiding major obstacles in the scaling up of the OHP photoelectrodes. The constructed OHP module is composed of a total of 16 OHP photoelectrodes, and a photocurrent of 11.52 mA is achieved under natural sunlight without external bias. The successful operation of unassisted solar water splitting using the OHP module without external bias can provide insights into the design of scalable OHP-based PEC systems for future practical application and commercialization.

14 SOLAR ENERGY↗

NASA NTRS1984

Coupled-mode analysis of phase-locked injection laser arrays

A coupled-mode analysis has been developed to describe the output of phase-locked injection laser arrays. It is shown that an array of emitters with weak coupling can only operate in a set of discrete modes determined by the number of and the spacing of the emitters. The interaction between emitters leads to a splitting of the common frequency of operation that can be estimated from the coupling strength. The coupled-mode analysis is compared to calculations based on simple diffraction theory. A consequence of the analysis is an explanation for the commonly observed discrepancy between experimentally observed far-field lobe widths and those predicted by simple diffraction theory.

Butler, J. K.↗

NASA NTRS1983

Low-level water vapor fields from the VISSR Atmospheric Sounder (VAS) 'split window' channels

A simple physical algorithm is presented which calculates the water vapor content of the lower troposphere from the 11 and 12 micron (split window) channels on the VISSR Atmospheric Sounder (VAS) on the Geostationary Operational Environmental Satellites. The algorithm is used to analyze a time series of VAS split window radiances observed at 15 km horizontal resolution over eastern North America during a 12 hr period on 13 July 1981. Results of the color coded images of the derived precipitable water fields are found to show vivid water vapor features whose broad structure and evolution are verified by the radiosonde and surface networks. The satellite moisture fields also show significant mesoscale features and rapid developments which are not resolved by the conventional networks. The VAS split window is determined to clearly differentiate those areas in which water vapor extends over a deep layer and is more able to support convective cells from those areas in which water vapor is confined to a shallow layer and is therefore less able to support convection. It is concluded that the VAS split windows can be used operationally to monitor mesoscale developments in the low-level moisture fields over relatively cloud-free areas of the United States.

Chesters, D.↗

NASA NTRS1986

An efficient method for solving the steady Euler equations

An efficient numerical procedure for solving a set of nonlinear partial differential equations is given, specifically for the steady Euler equations. Solutions of the equations were obtained by Newton's linearization procedure, commonly used to solve the roots of nonlinear algebraic equations. In application of the same procedure for solving a set of differential equations we give a theorem showing that a quadratic convergence rate can be achieved. While the domain of quadratic convergence depends on the problems studied and is unknown a priori, we show that firstand second-order derivatives of flux vectors determine whether the condition for quadratic convergence is satisfied. The first derivatives enter as an implicit operator for yielding new iterates and the second derivatives indicates smoothness of the flows considered. Consequently flows involving shocks are expected to require larger number of iterations. First-order upwind discretization in conjunction with the Steger-Warming flux-vector splitting is employed on the implicit operator and a diagonal dominant matrix results. However the explicit operator is represented by first- and seond-order upwind differencings, using both Steger-Warming's and van Leer's splittings. We discuss treatment of boundary conditions and solution procedures for solving the resulting block matrix system. With a set of test problems for one- and two-dimensional flows, we show detailed study as to the efficiency, accuracy, and convergence of the present method.

Liou, M. S.↗

NASA NTRS1992

A comparison of artificial compressibility and fractional step methods for incompressible flow computations

We have applied and compared the efficiency and accuracy of two commonly used numerical methods for the solution of Navier-Stokes equations. The artificial compressibility method augments the continuity equation with a transient pressure term and allows one to solve the modified equations as a coupled system. Due to its implicit nature, one can have the luxury of taking a large temporal integration step at the expense of higher memory requirement and larger operation counts per step. Meanwhile, the fractional step method splits the Navier-Stokes equations into a sequence of differential operators and integrates them in multiple steps. The memory requirement and operation count per time step are low, however, the restriction on the size of time marching step is more severe. To explore the strengths and weaknesses of these two methods, we used them for the computation of a two-dimensional driven cavity flow with Reynolds number of 100 and 1000, respectively. Three grid sizes, 41 x 41, 81 x 81, and 161 x 161 were used. The computations were considered after the L2-norm of the change of the dependent variables in two consecutive time steps has fallen below 10(exp -5).

Chan, Daniel C.↗

DOE OSTI2024

Interpenetrating 3D Electrodes for High-Rate Alkaline Water Splitting

Mass transfer is critical for the reaction kinetics and efficiency of alkaline water splitting (AWS). For AWS to operate at high current densities (hundreds of mA/cm 2 ), the device architecture must ensure a large catalytic surface area, rapid ion diffusion, and minimal solution and charge transfer resistances. Effective electrodes should also facilitate gas bubble detachment and release. 3D-printed electrodes have shown promise, but stacking them increases the ion diffusion length and solution resistance. Here we demonstrate a new device architecture with interpenetrating gyroid electrodes, providing a large ion-accessible surface area and gas diffusion channels. This design significantly reduces the interelectrode distance, lowering ion diffusion length and solution resistance. Simulations show faster ion diffusion and higher current density in the interpenetrating configuration compared with separate electrodes. This improved performance, especially at low temperatures and high current densities, highlights a promising strategy for enhancing AWS and other electrochemical systems limited by slow ion diffusion.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1972

Cold-air investigation of a turbine for high-temperature-engine application. 4: Two-stage turbine performance

The efficiency of a two-stage turbine is discussed. The turbine efficiency was 0.932 for equivalent design operating conditions (speed) and specific work, which compares closely to the value of 0.929 that would be estimated using the first-stage efficiency. The mass flow obtained with the two-stage configuration indicated that the mass flow characteristics of the two stages were closely matched at design operating conditions. The stage work split at these conditions was 0.505-0.495, which was close to the design work split of 0.515-0.485.

Whitney, W. J.↗