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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 397 records · Page 22

Superconducting Cavity Cryomodule Designs for the Next Generation of CW Linacs: Challenges and Options

The designs of nearly all superconducting RF (SRF) linacs over the last several years, with one notable exception being CEBAF at Jefferson Lab, have assumed pulsed beam operation with relatively low duty factors. These include the XFEL at DESY, the ILC, the original configuration for Project X at Fermilab, as well as several others. Recently proposed projects, on the other hand, including the LCLS-II at SLAC, the newly configured low and medium energy sections for Project X, and FRIB at Michigan State, to name a few, assume continuous wave or CW operation on quite a large scale with ambitious gradients and cavity performance requirements. This has implications in the cavity design as well as in many parts of the overall cryomodule due to higher dynamic heat loads in the cavities themselves and higher heat loads in the input and high-order-mode (HOM) couplers. Piping internal to the cryomodule, the effectiveness of thermal intercepts, the size of integrated heat exchangers, and many other aspects of the overall design are also affected. This paper will describe some of these design considerations as we move toward the next generation of accelerator projects.

43 PARTICLE ACCELERATORS↗

Efficient optimization method for finding minimum energy paths of magnetic transitions

Here, efficient algorithms for the calculation of minimum energy paths of magnetic transitions are implemented within the geodesic nudged elastic band (GNEB) approach. While an objective function is not available for GNEB and a traditional line search can, therefore, not be performed, the use of limited memory Broyden–Fletcher–Goldfarb–Shanno (LBFGS) and conjugate gradient algorithms in conjunction with orthogonal spin optimization (OSO) approach is shown to greatly outperform the previously used velocity projection and dissipative Landau–Lifschitz dynamics optimization methods. The implementation makes use of energy weighted springs for the distribution of the discretization points along the path and this is found to improve performance significantly. The various methods are applied to several test problems using a Heisenberg-type Hamiltonian, extended in some cases to include Dzyaloshinskii–Moriya and exchange interactions beyond nearest neighbours. Minimum energy paths are found for magnetization reversals in a nano-island, collapse of skyrmions in two-dimensional layers and annihilation of a chiral bobber near the surface of a three-dimensional magnet. The LBFGS-OSO method is found to outperform the dynamics based approaches by up to a factor of 8 in some cases.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

A new method for the experimental heating of intact soil profiles for application to climate change experiments

Advanced facilities are needed to evaluate the response of complex ecosystems to projected unique climate conditions not observable in the context of current natural variation or through the use of climate gradients. A next-generation, experimental system for simulating future belowground temperature increases was conceived, simulated, constructed and tested in a temperate deciduous forest in Oak Ridge, Tennessee, USA. The new system uses low-wattage, 3-m deep, circumferentially-installed heaters surrounding a defined soil volume to both add the necessary energy to support a set-point soil temperature differential within the treatment area and to add exterior energy inputs equal to that which might be lost from lateral heat conduction. This approach, which is designed to work in conjunction with aboveground heated chambers, requires only two control positions, (1) aboveground air temperatures at 1 m and (2) belowground temperatures at 0.8 m. The approach is capable of achieving in situ target temperature differentials in the tested range of +4.0 0.5 C for soils to a measured depth of -2 m located within the aboveground boundary for air heating. These differentials were sustained throughout 2009, and both diurnal and seasonal cycles at all soil depths were retained using this simple heating approach. Measured mean energy inputs required to sustain the target heating level of +4 C over the 7.1 m2 target area were substantial: 21.1 kW h d-1 m-2 for aboveground heating but 16 times lower for belowground heaters at 1.3 kW h d-1 m-2. Observations of soil CO2 efflux from the surface of the target soil volumes showed CO2 losses throughout 2009 that were elevated above the temperature response curve for control CO2 losses at levels greater than have been reported in previous soil warming studies. Stimulation of biological activity of previously undisturbed deep-soil carbon stocks is the expected source. Long-term research programs may be able to apply similar experimental systems to address uncertainties in process-level responses of microbial, plant, and animal communities in whole, intact ecosystems using this new heating method that capture expected future warming and temperature dynamics throughout the soil profile.

54 ENVIRONMENTAL SCIENCES↗

Trustworthy Physics-Informed Deep Learning for Predictive Scientific Computing

This project has developed powerful trustworthy physics-informed deep learning (TPiDL) models and methods to fundamentally enhance the scale and power of computational modeling in the scientific and engineering domains. Deep learning (DL) has radically advanced the state-of-the-art in machine learning, computer vision, natural language processing, and also scientific computing. Nevertheless, progress has been driven almost entirely by empirical observations, hacks, and tricks. Under the support of this project, the graph operator learning tools and advanced trustworthy physical informed neural networks have been developed. In addition, stochastic gradient replica-exchange Markov Chain Monte Carlo (MCMC) sampling algorithms have been designed to quantify the uncertainties and speed up the training of large-scale neural networks.

97 MATHEMATICS AND COMPUTING↗

Towards reverse mode automatic differentiation of Kokkos-based codes

Derivative computation is a key component of optimization, sensitivity analysis, uncertainty quantification, and the solving of nonlinear problems. Automatic differentiation (AD) is a powerful technique for evaluating such derivatives, and in recent years, has been integrated into programming environments such as Jax, PyTorch, and TensorFlow to support derivative computations needed for training of machine learning models, facilitating wide-spread use of these technologies. The C++ language has become the de facto standard for scientific computing due to numerous factors, yet language complexity has made the wide-spread adoption of AD technologies for C++ difficult, hampering the incorporation of powerful differentiable programming approaches into C++ scientific simulations. This is exacerbated by the increasing emergence of architectures, such as GPUs, with limited memory capabilities and requiring massive thread-level concurrency. C++ AD tools must effectively use these environments to bring novel scientific simulations to next-generation DOE experimental and observational facilities. In this project, we investigated source transformation-based automatic differentiation using LLVM compiler infrastructure to automatically generate portable and efficient gradient computations of Kokkos-based code. We have demonstrated that our proposed strategy is feasible by investigating the usage of a prototype LLVM-based source transformation tool to generate gradients of simple functions made of sequences of simple Kokkos parallel regions. Speedups of up to 500x compared to Sacado were observed on NVIDIA V100 GPU.

97 MATHEMATICS AND COMPUTING↗

Discovery, Design, Synthesis and Testing of High Performance Structural Alloys (Final Technical Report)

The overarching goal of this project is to understand the phase stability and mechanical behavior of non-stoichiometric multi-principal element alloy (MPEA) materials. In order to identify suitable alloys, we plan to use a combinatorial thin film screening approach, in collaboration with scientists at Lawrence Berkeley National Laboratory who are performing computational work as well as complementary experimental work. Specific tasks within the scope of this project include the fabrication, using thin film deposition from six sputtering targets, of combinatorial samples with multi-dimensional gradients in composition and microstructure. These samples are studied to screen MPEA systems for promising candidate alloys with specific composition(s), based on characterization of composition, structure and mechanical behavior across the thin film. We want to produce single-phase MPEAs with chemical homogeneity in a given thin film region, simple grain structures, and no intermetallic phases present. Gradient films facilitate first-pass screening for desirable characteristics and inform the next stage of work that involves fabrication of bulk MPEA specimens for (tensile) mechanical testing and characterization. To make the bulk alloys, metal (elemental) pieces are melted to form MPEAs, followed by heat treatment to homogenize the composition and microstructure. A subset of alloys is also cast, using vacuum arc melting, to yield larger samples (diameter ~1 cm and length ~5-10 cm) and these allow us to assess viability of scale-up for the alloys in structural applications. Further processing plans include rolling and heat treatment to recrystallize selected bulk MPEAs and grow grains to different extents, in order to investigate size effects in the mechanical behavior of MPEAs. Microspecimen testing will be performed (primarily in tension) to assess the mechanical behavior over a range of temperatures. The deformation microstructure of mechanically tested alloys will be characterized using transmission electron microscopy (TEM) to provide a scientific basis for understanding the structure-property relationships in MPEA mechanical behavior.

36 MATERIALS SCIENCE↗

TOPLA: A New Empirical Representation of the F-Region Topside and Plasmasphere for the International Reference Ionosphere

The goal of this LWS tools effort is the development of a new data-based F-region TOpside and PLAsmasphere (TOPLA) model for the electron density (Ne) and temperature (Te) for inclusion in the International Reference Ionosphere (IRI) model using newly available satellite data and models for these regions. The IRI model is the de facto international standard for specification of ionospheric parameters and is currently being considered as an ISO Technical Specification for the ionosphere. Our effort is directed towards improving the topside part of the model and extending it into the plasmasphere. Specifically we are planning to overcome the following shortcomings of the current IRI topside model: (I) overestimation of densities above 700 km by a factor of 2 and more, (3) unrealistically steep density profiles at high latitudes during very high solar activities, (4) no solar cycle variations and no semi-annual variations for the electron temperature, (5) discontinuities or unphysical gradients when merging with plasmaspheric models. We will report on first accomplishments and on the current status of the project.

Bilitza, D.↗

Connecting Regional Aerosol Emissions Reductions to Local and Remote Precipitation Responses

The unintended climatic implications of aerosol and precursor emission reductions implemented to protect public health are poorly understood. We investigate the precipitation response to regional changes in aerosol emissions using three coupled chemistry-climate models: NOAA Geophysical Fluid Dynamics Laboratory Coupled Model 3 (GFDL-CM3), NCAR Community Earth System Model (CESM1), and NASA Goddard Institute for Space Studies ModelE2 (GISS-E2). Our approach contrasts a long present-day control simulation from each model (up to 400 years with perpetual year 2000 or 2005 emissions) with 14 individual aerosol emissions perturbation simulations (160-240 years each). We perturb emissions of sulfur dioxide and/or carbonaceous aerosol within six world regions and assess the significance of precipitation responses relative to internal variability determined by the control simulation and across the models. Global and regional precipitation mostly increases when we reduce regional aerosol emissions in the models, with the strongest responses occurring for sulfur dioxide emissions reductions from Europe and the United States. Precipitation responses to aerosol emissions reductions are largest in the tropics and project onto the El Nino Southern Oscillation (ENSO). Regressing precipitation onto an Indo-Pacific zonal sea level pressure gradient index (a proxy for ENSO) indicates that the ENSO component of the precipitation response to regional aerosol removal can be as large as 20% of the total simulated response. Precipitation increases in the Sahel in response to aerosol reductions in remote regions because an anomalous interhemispheric temperature gradient alters the position of the Intertropical Convergence Zone (ITCZ). This mechanism holds across multiple aerosol reduction simulations and models.

Westervelt, Daniel M.↗

Post-Irradiation Examination to Quantify Irradiation-Induced Bowing of SiGA® Silicon Carbide Composite Structures (Final CRADA Report – NFE-23-09937)

As part of the SiC-based material development at General Atomics Electromagnetic Systems (GA-EMS), this project involved the first-of-a-kind experimental post-irradiation examination of the irradiation-induced bowing response in SiC composite structures under a neutron flux gradient. The SiC composite miniature channel specimen was provided by GA-EMS for the irradiation experiment. To quantify the irradiation-induced bowing of the channel specimen, a series of visual and dimensional inspections were conducted using the unique capabilities at Oak Ridge National Laboratory (ORNL), including a custom profilometry rig. The post-irradiation examination results of this project will assist GA-EMS in validating their fuel performance model for SiC-based core structures in neutron irradiation environments.

36 MATERIALS SCIENCE↗

Decoupling of Arctic variability from the North Pacific in a warmer climate

The sea level pressure variability in the North Pacific modulates the climate of the Arctic and surrounding continents, substantially impacting ecosystems and indigenous communities. Our analysis based on data from the CESM2 Large Ensemble and different Model Intercomparison Project datasets reveals that the interannual variability of Arctic surface air temperature (SAT) gradually decouples from the contemporaneous atmospheric conditions over the North Pacific as external forcing increases in intensity in the future. Future projections show that the North Pacific-Arctic relationship during the fall season consistently weakens in magnitude until the end of this century, and in the 22nd and 23rd centuries, the relationship is negligible throughout the year. We show that under increased greenhouse gas emissions, the regional heat fluxes extensively control the Arctic temperature variability, and the strength of the projected North Pacific-Arctic relationship is strongly dependent on the Arctic sea ice extent. Our results suggest that under future warming, a strong coupling of Arctic SAT with the underlying ocean and a weakening of the meridional pressure gradient driven by an enhanced rate of sea ice retreat will weaken the interannual footprint of North Pacific variability on Arctic SAT. Therefore, we propose that the alarming rate of sea-ice decline over recent decades and projected in the near future could accelerate the rate of decoupling. Further, we suggest that mitigation strategies for the Arctic should focus on regional mechanisms operating on interannual and seasonal timescales.

54 ENVIRONMENTAL SCIENCES↗

Macroinvertebrate community responses to gravel augmentation in a high-gradient, Southeastern regulated river

Sediment transport, one of the key processes of river systems, is altered or stopped by dams, leaving lower river reaches barren of sand and gravel, both of which are essential habitat for fish and macroinvertebrates. One way to compensate for losses in sediment is to supplement gravel to river reaches below impoundments. Because gravel addition has become a widespread practice, it is essential to evaluate the biotic response to restoration projects in order to improve the efficacy of future applications. The purpose of our study was to evaluate the response of the macroinvertebrate community to gravel addition in a high-gradient, regulated river in western North Carolina. We collected benthic macroinvertebrate samples from gravel-enhanced areas and unenhanced areas for 1 season before gravel addition, and for 4 seasons afterwards. Repeated measures multivariate analysis of variance indicated that the responses of macroinvertebrates to gravel addition were generally specific to individual taxa or particular functional feeding groups and did not lead to consistent patterns in overall family richness, diversity, density, or evenness. Non-metric multi-dimensional scaling showed that shifts in macroinvertebrate community composition were temporary and dependent upon site conditions and season. Correlations between macroinvertebrate response variables and substrate microhabitat variables existed with or without the inclusion of data from enhanced areas, which suggests that substrate-biotic relationships were present before gravel addition. A review of the current literature suggests that the responses of benthic macroinvertebrates to substrate restoration are inconsistent and dependent upon site conditions and the degree habitat improvement of pre-restoration site conditions.

functional feeding group↗

RF BREAKDOWN STUDIES USING PRESSURIZED CAVITIES

Many present and future particle accelerators are limited by the maximum electric gradient and peak surface fields that can be realized in RF cavities. Despite considerable effort, a comprehensive theory of RF breakdown has not been achieved and mitigation techniques to improve practical maximum accelerating gradients have had only limited success. Part of the problem is that RF breakdown in an evacuated cavity involves a complex mixture of effects, which include the geometry, metallurgy, and surface preparation of the accelerating structures and the make-up and pressure of the residual gas in which plasmas form. Studies showed that high gradients can be achieved quickly in 805 MHz RF cavities pressurized with dense hydrogen gas, as needed for muon cooling channels, without the need for long conditioning times, even in the presence of strong external magnetic fields. This positive result was expected because the dense gas can practically eliminate dark currents and multipacting. In this project we used this high pressure technique to suppress effects of residual vacuum and geometry that are found in evacuated cavities in order to isolate and study the role of the metallic surfaces in RF cavity breakdown as a function of magnetic field, frequency, and surface preparation. One of the interesting and useful outcomes of this project was the unanticipated collaborations with LANL and Fermilab that led to new insights as to the operation of evacuated normal-conducting RF cavities in high external magnetic fields. Other accomplishments included: (1) RF breakdown experiments to test the effects of SF6 dopant in H2 and He gases with Sn, Al, and Cu electrodes were carried out in an 805 MHz cavity and compared to calculations and computer simulations. The heavy corrosion caused by the SF6 components led to the suggestion that a small admixture of oxygen, instead of SF6, to the hydrogen would allow the same advantages without the corrosion in a practical muon beam line. (2) A 1.3 GHz RF test cell capable of operating both at high pressure and in vacuum with replaceable electrodes was designed, built, and power tested in preparation for testing the frequency and geometry effects of RF breakdown at Argonne National Lab. At the time of this report this cavity is still waiting for the 1.3 GHz klystron to be available at the Wakefield Test Facility. (3) Under a contract with Los Alamos National Lab, an 805 MHz RF test cavity, known as the All-Seasons Cavity (ASC), was designed and built by Muons, Inc. to operate either at high pressure or under vacuum. The LANL project to use the (ASC) was cancelled and the testing of the cavity has been continued under the grant reported on here using the Fermilab Mucool Test Area (MTA). The ASC is a true pillbox cavity that has performed under vacuum in high external magnetic field better than any other and has demonstrated that the high required accelerating gradients for many muon cooling beam line designs are possible. (4) Under ongoing support from the Muon Acceleration Program, microscopic surface analysis and computer simulations have been used to develop models of RF breakdown that apply to both pressurized and vacuum cavities. The understanding of RF breakdown will lead to better designs of RF cavities for many applications. An increase in the operating accelerating gradient, improved reliability and shorter conditioning times can generate very significant cost savings in many accelerator projects.

43 PARTICLE ACCELERATORS↗

An Update on the DOE Early Career Project on Photonic Band Gap Accelerator Structures

We performed fabrication of two SRF PBG resonators at 2.1 GHz and demonstrated their proof-of-principle operation at high gradients. Measured characteristics of the resonators were in good agreement with theoretical predictions. We demonstrated that SRF PBG cavities can be operated at 15 MV/m accelerating gradients. We completed the design and started fabrication of the 16-cell PBG accelerating structure at 11.7 GHz for wakefield testing at AWA.

43 PARTICLE ACCELERATORS↗

Space Synthetic Biology Project

Synthetic biology is an effort to make genetic engineering more useful by standardizing sections of genetic code. By standardizing genetic components, biological engineering will become much more similar to traditional fields of engineering, in which well-defined components and subsystems are readily available in markets. Specifications of the behavior of those components and subsystems can be used to model a system which incorporates them. Then, the behavior of the novel system can be simulated and optimized. Finally, the components and subsystems can be purchased and assembled to create the optimized system, which most often will exhibit behavior similar to that indicated by the model. The Space Synthetic Biology project began in 2012 as a multi-Center effort. The purpose of this project was to harness Synthetic Biology principals to enable NASA's missions. A central target for application was to Environmental Control & Life Support (ECLS). Engineers from NASA Marshall Space Flight Center's (MSFC's) ECLS Systems Development Branch (ES62) were brought into the project to contribute expertise in operational ECLS systems. Project lead scientists chose to pursue the development of bioelectrochemical technologies to spacecraft life support. Therefore, the ECLS element of the project became essentially an effort to develop a bioelectrochemical ECLS subsystem. Bioelectrochemical systems exploit the ability of many microorganisms to drive their metabolisms by direct or indirect utilization of electrical potential gradients. Whereas many microorganisms are capable of deriving the energy required for the processes of interest (such as carbon dioxide (CO2) fixation) from sunlight, it is believed that subsystems utilizing electrotrophs will exhibit smaller mass, volume, and power requirements than those that derive their energy from sunlight. In the first 2 years of the project, MSFC personnel conducted modeling, simulation, and conceptual design efforts to assist the project in selecting the best approaches to the application of bioelectrochemical technologies to ECLS. Figure 1 shows results of simulation of charge transport in an experimental system. Figure 2 shows one of five conceptual designs for ECLS subsystems based on bioelectrochemical reactors. Also during the first 2 years, some work was undertaken to gather fundamental data (conductivities, overpotentials) relevant to the modeling efforts.

Howard, David↗

The Pilot Land Data System (PLDS) at the Ames Research Center manages aircraft data in collaboration with an ecosystem research project

The Pilot Land Data System (PLDS) is a data and information system serving NASA-supported investigators in the land science community. The three nodes of the PLDS, one each at the Ames Research Center (ARC), the Goddard Space Flight Center (GSFC) and the Jet Propulsion Laboratory (JPL), cooperate in providing consistent information describing the various data holding in the hardware and software (accessible via network and modem) that provide information about and access to PLDS-held data, which is available for distribution. A major new activity of the PLDS node at the Ames Research Center involves the interaction of the PLDS with an active NASA ecosystem science project, the Oregon Transect Ecosystems Research involves the management of, access to, and distribution of the large volume of widely-varying aircraft data collected by OTTER. The OTTER project, is managed by researchers at the Ames Research Center and Oregon State University. Its principal objective is to estimate major fluxes of carbon, nitrogen, and water of forest ecosystems using an ecosystem process model driven by remote sensing data. Ten researchers at NASA centers and universities are analyzing data for six sites along a temperature-moisture gradient across the western half of central Oregon (called the Oregon Transect). Sensors mounted on six different aircraft have acquired data over the Oregon Transect in support of the OTTER project.

Angelici, Gary↗

3D Printing of Compositional Gradients Using the Microfluidic Circuit Analogy

3D printing of structures with compositional gradients requires accurate dispensing control to achieve desired profiles. Here, empirical data are used with a model based on the microfluidic circuit analogy (MCA) to project dispense rate profiles that yield improved compositional accuracy in the printed part. Since minor variation in the experimental setup for each printing session can result in significant changes, a calibration procedure is developed to measure the system response. This calibration enables the extraction of the empirical MCA model parameters specific to each print session. Using the empirical parameters, the MCA model then can be used to predict appropriate dispense rates for the desired composition profile and toolpath of interest. Here, the MCA model is validated experimentally by direct ink write 3D printing of compositional gradients using viscoelastic polydimethylsiloxane inks and is shown to improve accuracy to desired profile by a factor of 2–5. This approach enables a new route to 3D print structures with arbitrarily complex compositional gradients.

36 MATERIALS SCIENCE↗

Superfluid helium cryogenic systems for superconducting RF cavities at KEK

Recent accelerator projects at KEK, such as the Superconducting RF Test Facility (STF) for R and D of the International Linear Collider (ILC) project and the compact Energy Recovery Linac (cERL), employ superconducting RF cavities made of pure niobium, which can generate high gradient acceleration field. Since the operation temperature of these cavities is selected to be 2 K, we have developed two 2 K superfluid helium cryogenic systems for stable operation of superconducting RF cavities for each of STF and cERL. These two 2 K superfluid helium cryogenic systems are identical in principle. Since the operation mode of the cavities is different for STF and cERL, i.e. the pulse mode for STF and the continuous wave mode for cERL, the heat loads from the cavities are quite different. The 2 K superfluid helium cryogenic systems mainly consists of ordinary helium liquefiers/refrigerators, 2 K refrigerator cold boxes, helium gas pumping systems and high-performance transfer lines. The 2 K refrigerators and the high-performance transfer lines are designed by KEK. Some superconducting RF cavity cryomodules have been already connected to the 2 K superfluid helium cryogenic systems for STF and cERL respectively, and cooled down to 2 K successfully.

43 PARTICLE ACCELERATORS↗

Methods in PES-Learn: Direct-Fit Machine Learning of Born–Oppenheimer Potential Energy Surfaces

The release of PES-L EARN version 1.0 as an open-source software package for the automatic construction of machine learning models of semi-global molecular potential energy surfaces (PESs) is presented. Improvements to PES-L EARN ’s interoperability are stressed with new Python API that simplifies workflows for PES construction via interaction with QCSchema input and output infrastructure. In addition, a new machine learning method is introduced to PES-L EARN : kernel ridge regression (KRR). The capabilities of KRR are emphasized with examination of select semi-global PESs. All machine learning methods available in PES-L EARN are benchmarked with benzene and ethanol datasets from the rMD17 database to illustrate PES-L EARN ’s performance ability. Fitting performance and timings are assessed for both systems. Finally, the ability to predict gradients with neural network models is presented and benchmarked with ethanol and benzene. PES-L EARN is an active project and welcomes community suggestions and contributions.

kernel ridge regression↗