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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 883 records · Page 49

Accelerating laser ray tracing in high fidelity physics simulations of laser melting using squeeze U-net

Laser melting is a core component of the ongoing industrial revolution, dubbed Industry 4.0, as lasers facilitate fast and precise melting and fusion in advanced manufacturing. There is a strong need to optimize the laser process using simulations. However, this has proven challenging as high fidelity simulations are needed for predictive modeling and this is currently prohibitively expensive even when run on hundreds of processors on high performance computers. The challenge is capturing complex physics of laser material interaction, fluid dynamics, thermal physics and material phase transformations at various length and time scales. To close this technological gap, we modified a squeeze U-net to accelerate the laser ray tracing component of such high fidelity models by ~4x–40x while preserving the core physics principle of conservation of energy with 97% accuracy. This approach enables the accurate modeling of global laser energy absorption as a function of local surface temperatures and complex surface topologies, which govern the reflection directions and energy losses of laser rays upon interacting with the material surface.

Computer science↗

Searches for baryon number violation in neutrino experiments: a white paper

Abstract Baryon number conservation is not guaranteed by any fundamental symmetry within the standard model, and therefore has been a subject of experimental and theoretical scrutiny for decades. So far, no evidence for baryon number violation has been observed. Large underground detectors have long been used for both neutrino detection and searches for baryon number violating processes. The next generation of large neutrino detectors will seek to improve upon the limits set by past and current experiments and will cover a range of lifetimes predicted by several Grand Unified Theories. In this White Paper, we summarize theoretical motivations and experimental aspects of searches for baryon number violation in neutrino experiments.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

The 2021 room-temperature superconductivity roadmap

Designing materials with advanced functionalities is the main focus of contemporary solid-state physics and chemistry. Research efforts worldwide are funneled into a few high-end goals, one of the oldest, and most fascinating of which is the search for an ambient temperature superconductor (A-SC). The reason is clear: superconductivity at ambient conditions implies being able to handle, measure and access a single, coherent, macroscopic quantum mechanical state without the limitations associated with cryogenics and pressurization. This would not only open exciting avenues for fundamental research, but also pave the road for a wide range of technological applications, affecting strategic areas such as energy conservation and climate change. In this roadmap we have collected contributions from many of the main actors working on superconductivity, and asked them to share their personal viewpoint on the field. The hope is that this article will serve not only as an instantaneous picture of the status of research, but also as a true roadmap defining the main long-term theoretical and experimental challenges that lie ahead. Interestingly, although the current research in superconductor design is dominated by conventional (phonon-mediated) superconductors, there seems to be a widespread consensus that achieving A-SC may require different pairing mechanisms.

"Toward hot superconductivity"↗

Accelerating the Adoption of Energy Efficiency and Renewables in Warehouses and Distribution Centers

Commercial warehouses and storage facilities represent a large part of the commercial buildings in the United States, and their share increases every year. NREL is working with the U.S. Department of Energy to understand barriers, sector needs, and opportunities to enhance sustainability in the warehouse sector, driving ultra-high efficient, zero-energy design, while considering electrification in buildings and vehicles, grid-friendly operation, and decarbonization. After investigating literature about warehouse sustainability practices and high-performance warehouse case studies, several one-on-one interviews were carried out with warehouse managers and stakeholders. Data collected through literature and the interviews were captured to provide the current status of warehousing in the context of energy efficiency, renewables, carbon emissions, and overall sustainability. The results are intended to inform areas for new research and deployment activities to achieving zero energy and zero carbon goals.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Control-oriented modeling of combustion and flow processes in liquid propellant rocket engines

This paper presents a control-oriented model of the flow, reaction, and transport processes in liquid propellant rocket combustion chambers, based on the multicomponent conservation laws of gas dynamics. This model provides a framework for the inclusion of detailed chemical kinetic relations, viscous and other dissipative effects, a variety of actuators and sensors, as well as process and measurement disturbances. In addition to its potential usefulness to the designer in understanding the dynamical complexity of the system and the sources of model uncertainty, the model provides a rigorous basis for control system design. An appraisal of current and feasible actuators and sensors, and their mathematical representation are included.

Bentsman, Joseph↗

New developments in the method of space-time conservation element and solution element: Applications to the Euler and Navier-Stokes equations

A new numerical framework for solving conservation laws is being developed. This new approach differs substantially in both concept and methodology from the well-established methods--i.e., finite difference, finite volume, finite element, and spectral methods. It is conceptually simple and designed to avoid several key limitations to the above traditional methods. An explicit model scheme for solving a simple 1-D unsteady convection-diffusion equation is constructed and used to illuminate major differences between the current method and those mentioned above. Unexpectedly, its amplification factors for the pure convection and pure diffusion cases are identical to those of the Leapfrog and the DuFort-Frankel schemes, respectively. Also, this explicit scheme and its Navier-Stokes extension have the unusual property that their stabilities are limited only by the CFL condition. Moreover, despite the fact that it does not use any flux-limiter or slope-limiter, the Navier-Stokes solver is capable of generating highly accurate shock tube solutions with shock discontinuities being resolved within one mesh interval. An accurate Euler solver also is constructed through another extension. It has many unusual properties, e.g., numerical diffusion at all mesh points can be controlled by a set of local parameters.

Chang, Sin-Chung↗

Computational Aeroacoustics by the Space-time CE/SE Method

In recent years, a new numerical methodology for conservation laws-the Space-Time Conservation Element and Solution Element Method (CE/SE), was developed by Dr. Chang of NASA Glenn Research Center and collaborators. In nature, the new method may be categorized as a finite volume method, where the conservation element (CE) is equivalent to a finite control volume (or cell) and the solution element (SE) can be understood as the cell interface. However, due to its rigorous treatment of the fluxes and geometry, it is different from the existing schemes. The CE/SE scheme features: (1) space and time treated on the same footing, the integral equations of conservation laws are solve( for with second order accuracy, (2) high resolution, low dispersion and low dissipation, (3) novel, truly multi-dimensional, simple but effective non-reflecting boundary condition, (4) effortless implementation of computation, no numerical fix or parameter choice is needed, an( (5) robust enough to cover a wide spectrum of compressible flow: from weak linear acoustic waves to strong, discontinuous waves (shocks) appropriate for linear and nonlinear aeroacoustics. Currently, the CE/SE scheme has been developed to such a stage that a 3-13 unstructured CE/SE Navier-Stokes solver is already available. However, in the present paper, as a general introduction to the CE/SE method, only the 2-D unstructured Euler CE/SE solver is chosen as a prototype and is sketched in Section 2. Then applications of the CE/SE scheme to linear, nonlinear aeroacoustics and airframe noise are depicted in Sections 3, 4, and 5 respectively to demonstrate its robustness and capability.

Loh, Ching Y.↗

Crystal structure of the 4-hydroxybutyryl-CoA synthetase (ADP-forming) from nitrosopumilus maritimus

The 3-hydroxypropionate/4-hydroxybutyrate (3HP/4HB) cycle from ammonia-oxidizing Thaumarchaeota is currently considered the most energy-efficient aerobic carbon fixation pathway. The Nitrosopumilus maritimus 4-hydroxybutyryl-CoA synthetase (ADP-forming; Nmar_0206) represents one of several enzymes from this cycle that exhibit increased efficiency over crenarchaeal counterparts. This enzyme reduces energy requirements on the cell, reflecting thaumarchaeal success in adapting to low-nutrient environments. Here we show the structure of Nmar_0206 from Nitrosopumilus maritimus SCM1, which reveals a highly conserved interdomain linker loop between the CoA-binding and ATP-grasp domains. Phylogenetic analysis suggests the widespread prevalence of this loop and highlights both its underrepresentation within the PDB and structural importance within the (ATP-forming) acyl-CoA synthetase (ACD) superfamily. This linker is shown to have a possible influence on conserved interface interactions between domains, thereby influencing homodimer stability. These results provide a structural basis for the energy efficiency of this key enzyme in the modified 3HP/4HB cycle of Thaumarchaeota.

59 BASIC BIOLOGICAL SCIENCES↗

Direct tests of cytochrome c and c 1 functions in the electron transport chain of malaria parasites

The mitochondrial electron transport chain (ETC) of Plasmodium malaria parasites is a major antimalarial drug target, but critical cytochrome (cyt) functions remain unstudied and enigmatic. Parasites express two distinct cyt c homologs (c and c-2) with unusually sparse sequence identity and uncertain fitness contributions. P. falciparum cyt c-2 is the most divergent eukaryotic cyt c homolog currently known and has sequence features predicted to be incompatible with canonical ETC function. We tagged both cyt c homologs and the related cyt c1 for inducible knockdown. Translational repression of cyt c and cyt c1 was lethal to parasites, which died from ETC dysfunction and impaired ubiquinone recycling. In contrast, cyt c-2 knockdown or knockout had little impact on blood-stage growth, indicating that parasites rely fully on the more conserved cyt c for ETC function. Biochemical and structural studies revealed that both cyt c and c-2 are hemylated by holocytochrome c synthase, but UV-vis absorbance and EPR spectra strongly suggest that cyt c-2 has an unusually open active site in which heme is stably coordinated by only a single axial amino acid ligand and can bind exogenous small molecules. These studies provide a direct dissection of cytochrome functions in the ETC of malaria parasites and identify a highly divergent Plasmodium cytochrome c with molecular adaptations that defy a conserved role in eukaryotic evolution.

60 APPLIED LIFE SCIENCES↗

Comoparison of Slit Trench and Engineered Trench 3D Vadose Zone Conceptual Models

In the next revision of the E-Area Low-Level Waste Facility (ELLWF) Performance Assessment (PA), radionuclide groundwater transport from slit (ST) and engineered trenches (ET) will be simulated using 3-dimensional PORFLOW models representing the vadose zone. In total, the conceptual framework will aim to model 29 total trenches with a degree of conservatism that provides a high level of confidence in meeting performance objectives. The implementation of generic conceptual models allows for a reasonable number of simulation scenarios, thereby reducing the chances of errors and enabling a better one-to-one comparison between the results, while still capturing the most important features of each trench. The current investigation seeks to understand if a generic trench model based on the general ET footprint can justifiably be used for representing both STs and ETs while maintaining a reasonable degree of conservatism. In this process, the groundwater transport of several key radionuclides was simulated for both ET and ST geometries and the flux-to-the-water-table profiles were compared. For all radionuclides simulated, the ET geometry is shown to be conservative (i.e., produces the highest peak flux to the water table).

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Aerothermal Analysis of the Project Fire II Afterbody Flow

Computational fluid dynamics (CFD) is used to simulate the wake flow and afterbody heating of the Project Fire II ballistic reentry to Earth at 11.4 km/sec. Laminar results are obtained over a portion of the trajectory between the initial heat pulse and peak afterbody heating. Although non-catalytic forebody convective heating results are in excellent agreement with previous computations, initial predictions of afterbody heating were about a factor of two below the experimental values. Further analysis suggests that significant catalysis may be occurring on the afterbody heat shield. Computations including finite-rate catalysis on the afterbody surface are in good agreement with the data over the early portion of the trajectory, but are conservative near the peak afterbody heating point, especially on the rear portion of the conical frustum. Further analysis of the flight data from Fire II shows that peak afterbody heating occurs before peak forebody heating, a result that contradicts computations and flight data from other entry vehicles. This result suggests that another mechanism, possibly pyrolysis, may be occurring during the later portion of the trajectory, resulting in less total heat transfer than the current predictions.

Wright, Michael J.↗

High-Order Entropy Stable Formulations for Computational Fluid Dynamics

A systematic approach is presented for developing entropy stable (SS) formulations of any order for the Navier-Stokes equations. These SS formulations discretely conserve mass, momentum, energy and satisfy a mathematical entropy inequality. They are valid for smooth as well as discontinuous flows provided sufficient dissipation is added at shocks and discontinuities. Entropy stable formulations exist for all diagonal norm, summation-by-parts (SBP) operators, including all centered finite-difference operators, Legendre collocation finite-element operators, and certain finite-volume operators. Examples are presented using various entropy stable formulations that demonstrate the current state-of-the-art of these schemes.

Carpenter, Mark H.↗

Efficient Air Dehumidification Can Save 15%-50% of Cooling Energy in Commercial Buildings

Current approach to dehumidification in commercial buildings with chilled/hot water AHU systems is to overcool return + supply air to dewpoint, and then reheat before supply to zone. This is energy inefficient, with reheat often being gas-fired. To reduce energy consumption, building operators will often operate at little-to-no outside air, sacrificing IAQ. Decarbonizing commercial buildings requires solutions to reduce and fully electrify dehumidification energy consumption. The Altaire ADAPT and Conservant HEDS systems aim to solve this problem by decoupling humidity control from cooling reduces energy consumption while enabling improved IAQ management.

commercial buildings↗

Building envelope anomaly characterization and simulation using drone time-lapse thermography

Defects in building envelopes deteriorate over time without being visible to the human eye, while significantly impacting energy performance due to unaccounted heat transfer. Defects can be characterized in the infrared (IR) spectrum. However, IR readings are typically recorded at singular points in time, when in several cases anomalies can only be revealed at specific times of the day, possibly in different seasons of the year. This paper presents a novel workflow for 3D envelope defect characterization and modeling using aerial time-lapse IR data collection using drones. A comprehensive envelope thermal profile is developed for a case study building employing the photogrammetry software Agisoft Photoscan, which generates temporal IR inspections of building skins using multiple thermography orthomosaics. Point-cloud data is then translated into a CAD model and thermal zones for whole Building Energy Modeling (BEM) using Honeybee as a frontend to EnergyPlus to showcase the potential of inclusion of detailed 4D data. Envelope contributions in this case study’s anomalies showed heat losses of 6447.6 kWh, and Energy Use Intensity (EUI) differences of ~2 kWh/m 2 /year from the baseline. Finally, why there is currently little translation of this work in BEM software is discussed, while identifying limitations and future research in the employment of time-lapse thermography using drones for more accurate building envelope inspection and modeling.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Building Technologies Office: Peer Review Report 2019

To ensure BTO projects are relevant, effective, and productively assisting the Office in meeting its goals, BTO conducts an annual peer review. The peer review is a formal, documented evaluation process that uses objective criteria and qualified independent reviewers to judge BTO-funded projects in terms of their technical, scientific, or business merit; actual or anticipated results; and productivity and effectiveness. Knowledge about the quality and effectiveness of current BTO projects and programs is essential for improving existing activities and informing future efforts. The BTO Peer Review is free and open to the public and provides an opportunity to learn more about BTO’s various projects and initiatives as well as promote collaborations and partnerships.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Medium-duty Urban Range Extended Connected Powertrain (Final Scientific Technical Report)

The project goal is to develop and demonstrate a Class 4 delivery vehicle that reduces fuel consumption by 50% or more when compared to an equivalent vehicle with a conventional internal combustion engine (ICE) powertrain driven on a comparable duty cycle. This shall be achieved using a plug-in hybrid electric (PHEV) configuration that optimizes the efficiency of the ICE. The proposed solution aims to be commercially viable for fleets to procure the system without additional incentives. To accomplish this, commercialized light-duty vehicle electric drive components shall be used. A PHEV configuration for Class 4 MD/HD vocational vehicles using commercialized light-duty vehicle electric drive components will require the development of a new topology for the hybrid powertrain applicable to medium-duty vehicles. Prior research indicates that an identified novel power split device could provide a fuel economy improvement potential of up to 51%. Utilizing an advanced battery management algorithm that will allow operation closer to the battery limits, the project will minimize battery capacity to achieve the desired performance results while maintaining the cost target for high commercialization. The solution must be cost effective to purchase and integrate into a Class 4 delivery vehicle, deliver the intended fuel economy improvement, and perform as well, or better, than the current conventional ICE powertrain. MD/HD vehicles typically require higher power, which is one factor that results in high costs for the powerful electric machines typical in larger HEV/PHEV systems. A key element in the project is the use of commercially available Bosch electric drive components (e.g., motors, batteries, and power electronics) from the larger passenger vehicle segment. This leverages the economies of scale to decrease cost and improve reliability beyond current purpose-built low-volume commercial vehicle components. These innovations will result in a game-changing PHEV system that meets DOE’s 50% fuel consumption reduction target, grants the vehicle an uncompromised driving range, and achieves the cost point for widespread adoption.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Assessment of Commercial Composite Power Pole Performance

The objective of this report is to assess the performance of composite poles, considering price, durability, resilience to the effects of extreme weather, ongoing maintenance costs, ease of repair, preplacement or upgrading giving special consideration to performance in watersheds and flood prone environments. The report starts with a description of the history and functional requirements of power pole. This is followed by a survey of existing composite pole manufacturing processes with a survey of existing knowledge base answering the above performance requirements. For the information not currently available to the public, an overview of testing procedures is outlined. Finally, an overview of emerging trends in composites and potential opportunities to address technical and economic shortfalls is proposed.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Computational diagnostics for flame acceleration and transition to detonation in a hydrogen/air mixture

A new computational diagnostic method for pressure-induced compressibility is proposed by projecting its local contribution to the chemical explosive mode (CEM) in the chemical explosive mode analysis (CEMA) framework. The new method is validated for the study of detonation development during the deflagration-to-detonation transition (DDT) process. The flame characteristics are identified through the quantification of individual CEM contributions of chemical reaction, diffusion, and pressure-induced compressibility. Numerical simulations are performed to investigate the DDT processes in a stoichiometric hydrogen-air mixture. A Godunov algorithm, fifth-order in space, and third-order in time are used to solve the fully compressible Navier-Stokes equations on a dynamically adapting mesh. A single-step, calibrated chemical diffusive model (CDM) described by Arrhenius kinetics is used for energy release and conservation between the fuel and the product. The new diagnostic method is first applied to onedimensional (1D) canonical flame configurations followed by two-dimensional (2D) simulations of DDT in an obstructed channel where different detonation initiation scenarios are examined using the new CEMA projection formulation. Detailed examinations of the idealized configuration of detonation initiation through shock focusing mechanism at a flame front are also studied using the new formulation. A comparison of the currently proposed CEMA projection and the original formulation by the authors suggests that including the pressure-induced compressibility is essential for the use of CEMA in DDT process. The results also show that the new formulation of CEMA projection can successively capture the detonation initiation through either a gradient mechanism or a direct initiation mechanism, and therefore can be used as an effective local analytical tool for the computational diagnostics of detonation initiation in a DDT process. It was found that detonation development is characterized by a strong contribution of chemistry role to the CEM which is pivotal to the initiation of detonation. The role of compressibility is found enhanced at the edge of the detonation front where diffusion was found to have minimal effects on detonation development.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗