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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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All sourcesNASA NTRSDOE OSTI
DOE OSTI2026

E3SMv3 ‘Nephele’ Perturbed Parameter Ensemble Value-Added Product for ENA, SGP, NSA, and Global Means

Processed output from the E3SMv3 Nephele perturbed parameter ensemble (PPE). This product contains global means of present-day (using 2010 aerosol forcings) and preindustrial (using 1850 aerosol forcings) monthly and daily global-mean quantities, as well as hourly mean quantities at the E3SMv3 model grid cell closest to the ENA, SGP, and NSA ARM sites. In this PPE, the E3SMv3 model was run for 27 months in an atmosphere-only configuration with free tropospheric winds nudged to reanalysis. Each ensemble member represents a unique combination of 25 model parameter values (in the microphysics, convective microphysics, and aerosol schemes) that were perturbed randomly and simultaneously. The E3SMv3 default configuration is included as member 0. See https://doi.org/10.22541/essoar.174907165.57104591/v1 (in review) for more information on the Nephele PPE and the perturbed parameters.

Model atmospheric temperature↗
DOE OSTI2026

Experimental Report: Multi-Instrument Comparison of AAF Size Distribution Instruments

Aerosols are particles suspended in the atmosphere, ranging in size from nanometers to micrometers. Their size distribution affects key atmospheric processes, including nucleation, coagulation, scavenging, activation, and radiative properties (Seinfeld and Pandis 2016). Aerosol size distribution is a critical parameter in atmospheric science, influencing processes such as cloud formation and radiative forcing. Accurate representation of aerosol size distributions is essential for understanding their impact on climate, air quality, and human health. However, aerosol size and composition vary significantly across time and space due to meteorological conditions and natural or anthropogenic sources. (Wu and Boor 2021). Various instruments are used to measure aerosol size distributions, each with distinct principles, advantages, and limitations. This report begins with an in-depth overview of aerosol size-distribution comparison studies, focusing on the passive cavity aerosol spectrometer probe (PCASP), portable optical particle spectrometer (POPS), ultra-high-sensitivity aerosol spectrometer (UHSAS), aerodynamic particle sizer (APS), and scanning mobility particle sizer (SMPS). All of these instruments are used by the U.S. Department of Energy Atmospheric Radiation Measurement (ARM) Aerial Facility (AAF), which commissioned this comparison and report. The report evaluates the strengths and weaknesses of these instruments, highlights their applications, and discusses efforts to merge data from multiple instruments for comprehensive analysis.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2019

Simulating 10,000 Years of Erosion to Assess Nuclear Waste Repository Performance

Long-term environmental performance assessments of natural processes, including erosion, are critically important for waste repository site evaluation. Yet, assessing a site’s ability to continuously function is challenging due to parameter uncertainty and compounding nonlinear processes. In lieu of unavailable site data for model calibration, we present a workflow to include multiple sources of surrogate data and reduced-order models to validate parameters for a long-term erosion assessment of a low-level radioactive nuclear waste repository. We apply this new workflow to a low-level waste repository on mesas in Los Alamos National Laboratory in New Mexico. To account for parameter uncertainty, we simulate high-, moderate-, and low-erosion cases. The assessment extends to 10,000 years, which results in large erosion uncertainties, but is necessary given the nature of the interred waste. Our long-term erosion analysis shows that high-erosion scenarios produce rounded mesa tops and partially filled canyons, diverging from the moderate-erosion case that results in gullies and sharp mesa rims. Our novel model parameterization workflow and modeling exercise demonstrates the utility of long-term assessments, identifies sources of erosion forecast uncertainty, and demonstrates the utility of landscape evolution model development. We end with a discussion on methods to reduce assessment uncertainty and increase model confidence.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2022

Squeeze Film Damper Experimental and Numerical Correlation: Test Setup Description and Parameter Identification of Dry System

The process of characterizing a damper involves both experimental techniques and model simulation. Experiments characterize dynamic behavior of a system through empirical modal analysis using impact and shaker testing. The layout of the test setup is crucial for a low-mass, nonlinear system. Physical arrangement, orientation of the system, and instrumentation affect the results that are discussed in this paper. These results can be used to validate a numerical simulation of the same system. With a validated model, important physical input parameters and modeling techniques can be determined and implemented in future designs. In other words, this modeling can be used with confidence to design alternative dampers that may be difficult, costly, and time-consuming to characterize experimentally.

Cook, Jason↗
DOE OSTI2024

History of the Beer Game

This article describes the history of the Beer Game. By triangulating information from literature, archival analysis, and interviews with experts in the field, the main changes in the game over its almost 70-year history are identified. The article discusses three aspects of the game: 1) its structure (phases of its history, stocks and flows, parameters, etc.); 2) the process for playing the game; and 3) the game debrief. The structure of the Beer Game, and the process for running it, have stabilized over the years into what is now a de facto standard approach. Additional work is needed in the game debrief, specifically in the clarification of key insights and messages (depending on the context of the use of the game), in how to communicate such messages to different audiences, and in the development of support materials for its delivery. © 2024 UChicago Argonne, LLC. System Dynamics Review published by John Wiley & Sons Ltd on behalf of System Dynamics Society.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2018

Editorial to the special issue on the 2015 TOUGH Symposium

This Special Issue of Transport in Porous Media features selected papers from the 2015 TOUGH Symposium, which took place on September 28–30, 2015, in Berkeley, California, USA. Such symposia are held every 3 years and are a forum where users of the TOUGH family of numerical simulators meet for an open exchange on the code applications and recent enhancements. The TOUGH codes (TOUGH is an acronym for Transport of Unsaturated Groundwater and Heat) were originally developed in the early 1980s for geothermal reservoir simulation by a team of researchers at the Lawrence Berkeley National Laboratory (LBNL) headed by Karsten Pruess (see http://esd.lbl.gov/TOUGH). The TOUGH codes have a modular structure in which different fluid components can be incorporated into the code by means of a replaceable equation of state (EOS) package. Since its first release, a variety of important EOS modules have been developed, enabling the modeling of volatile organic compounds, decay chains of multiple radionuclides, gas hydrates, tight and shale gas behavior, enhanced oil recovery, and supercritical water and CO 2 . Derivatives and descendants of the basic TOUGH code include coupled multi-phase flow and reactive chemical transport; coupled thermo-hydrologic-mechanical processes; inverse modeling for parameter estimation, sensitivity analysis, and uncertainty quantification; and parallelization for multi-core PCs, workstation clusters, and supercomputers. The TOUGH codes have been applied to a large variety of problems, including geothermal and petroleum reservoir engineering, nuclear waste and CO 2 geologic sequestration, subsurface environmental remediation, methane gas hydrate production, compressed air energy storage, and many other energy and environmental applications. Finally, the international TOUGH user community currently numbers almost 400 organizations (research laboratories, government agencies, private companies, universities, etc.) in over 60 countries.

99 GENERAL AND MISCELLANEOUS↗
DOE OSTI2018

Experimental Study of High-Velocity Projectile Impact Welding

The purpose of this study is to investigate the effect of various parameters on the welding process with high-velocity projectiles. For carrying out Impact Spot Welding tests, a single stage compressed gas gun impact test facility was used to launch flat- and conical-nosed projectiles within the velocity range from 100 to 150 m/s and performed. Different types of materials such as steel, copper, brass, and aluminum alloy were used. In the present experimental study, the steel plate with a thickness of 4 mm was considered as a back layer and the other plates made of copper, brass, and aluminum alloy were considered as front layers. Different gaps of 0.1, 0.2, and 0.5 mm were considered between the layers. The shape of the welded interface was studied by Scanning Electron Microscopy (SEM). The depth of penetration in the specimen and the kinetic energy of the projectiles were calculated. The experimental results showed that a complete bonding has occurred in the collision zone, especially in the central areas.

36 MATERIALS SCIENCE↗
DOE OSTI2024

GRCop-42: Comparison between laser powder bed fusion and laser powder direct energy deposition

This study involves a comparative analysis of additively manufactured GRCop-42 specimens produced using two processes: laser-powder bed fusion (L-PBF) and laser powder direct energy deposition (LP-DED). The investigation characterizes a range of material attributes, including surface topography, internal defects, microstructural features, quasi-static mechanical properties, and fractographic characteristics. The findings demonstrate that, despite the specimens being fabricated with the same base material, the resulting material properties vary significantly between the two additive manufacturing processes. As such, material properties cannot be presumed to be uniform across different manufacturing methods. Consequently, material characterization must be conducted for individual manufacturing processes based on specific parameters.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Economic and environmental performance of biomass gasification for renewable natural gas production in the context of the U.S. natural gas supply

Bioenergy technologies offer potential for reducing greenhouse gas (GHG) emissions. One such promising technology is biomass gasification, which is the conversion of biomass into renewable natural gas (RNG) for use with a natural gas combined-cycle power generation system. However, the associated economic and emission effects need to be better understood to enable optimal decision-making and avoid missed opportunities for enhancing efficiency and increasing system circularity. This analysis explores opportunities to (1) decarbonize natural-gas-based systems and (2) leverage the extensive US natural gas infrastructure to mobilize biomass resources to achieve environmental and economic benefits. Here, in this analysis, the research team used a spatially explicit biomass logistics model (integrated with relevant biomass availability, technoeconomic analysis, and life cycle assessment information) to simulate economically optimal biomass allocation for RNG production and use for decarbonization in the United States. Results show that the United States has the potential to produce 9203 million GJ of RNG within the expected range of $\$$12–30/GJ. Further analyses tested the overall RNG production system's sensitivity to economic and emissions parameters of nine different processes. The sensitivity analysis results indicate that the median carbon abatement cost of RNG is most sensitive to changes in emissions associated with conversion processes and land use changes. These findings provide a deeper understanding of RNG's economic and emission potential for decision-making and guiding future research.

09 BIOMASS FUELS↗
DOE OSTI2026

Effect of polymer structure and material properties on mechanochemical reaction environments for polymer recycling

Plastic waste accumulation necessitates innovative recycling approaches to achieve sustainability goals. Mechanochemical depolymerization offers a solvent-free, energy-efficient route to convert polymers into valuable monomers. In addition to their chemical properties, the way that polymers absorb kinetic energy is a key parameter of any mechanochemical process. This perspective explores the principles underpinning mechanochemical recycling, emphasizing how deformation and localized transient heating mediate energy transfer between impacts and localized excitations. Key factors such as polymer crystallinity, molecular weight, viscoelasticity, and thermal effects are analyzed to elucidate their role in energy transfer mechanisms during ball milling. This work establishes a foundational framework for the design and optimization of mechanochemical recycling by connecting polymer response to mechanical energy with the intention to improve depolymerization efficiency. Future research opportunities are outlined to advance the integration of polymer science and mechanochemistry for scalable, sustainable plastic upcycling.

ball mill↗
DOE OSTI2018

Environmental licensing in Brazilian's crushed stone industries

Highlights: • Failures in environmental reporting compromise the effectiveness of the environmental license process • The infrastructure of environmental agencies must be improved • The participation of society is essential for monitoring industries - Abstract: The crushed stone industries' activities are characterized by the extraction and processing of stones for use as aggregates in construction. The sector causes environmental impacts that can be mitigated by the implementation of control instruments, namely, environmental licensing, whose purpose is to carry out monitoring of potentially polluting activities. In this paper, it was analyzed the environmental studies of three industries located in Monsenhor Gil, Piauí, Brazil, elaborated as requisites for obtaining the environmental and mineral licenses. There were made visits to the State Department of Environment and Water Resources (SEMAR) and to the National Department of Mineral Production (DNPM) to verify the environmental reports and the environmental and mineral licensing processes. There were also made visits to the analyzed industries, with the aim of comparing the information contained in the studies, with the reality and verifying the implementation of the mitigating measures proposed in them, through the observation of the industries operation, and interviews with the responsible managers. Furthermore, it was made a research in the scientific literature, to know the licensing process in other countries, to compare with the Brazilian reality. From the research, in Brazilian industries, it was observed that, although all the legal steps to obtain the licenses have been fulfilled, the environmental reports have elaboration failures, such as the lack of a multidisciplinary team and the fact that some data diverge from the reality, decreasing the reliability of the evaluation of the environmental impacts caused by the projects. Also, the environmental replacement cost is not accounted in the final value of the product, and any of the industries have started the implementation of the proposed mitigation measures since they do not have mineral depletion areas. SEMAR was delayed in issuing licenses within the period established by law, and there are no periodic inspections by both the environmental agency and DNPM. It should also be pointed out that the community did not claim public hearings and there is no participation in environmental education projects, factors that compromise the effectiveness of the environmental licensing process. Regarding the process in other parts of the world, in some countries, such as Uruguay and Paraguay, the agency responsible for licensing and inspection is federal. In Argentina, as in Brazil and USA, states have autonomy to legislate on environmental issues. There is also divergence in the period of execution of the licenses, being 12 months in Brazil, while in Thailand it can be up to 56 days. In Peru, the society participation is much more representative than in Brazil, and there is differentiation in the collection form of environmental compensation fees, among countries. The failures pointed out in the Brazilian process, as well as the system of other countries, can serve as parameters for the improvement of the process' effectiveness, both in Brazil and in other parts of the world, aiming at the conservation of the environment.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2021

Accurate Dosimetry for Radiobiology

Accurate radiation dose is required to ensure reproducibility in establishing the radiobiological effect in biological systems among institutions. The dose should be the most precise and accurate parameter of the entire process. The goal is a system to provide uniform radiation dose verification among institutions that is traceable to the National Institute of Standards and Technology (NIST) through an Accredited Dosimetry Calibration Laboratory.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2018

Hydrogen induced cracking susceptibility of API 5L X70 pipeline steel in relation to microstructure and crystallographic texture developed after different thermomechanical treatments

Highlights: • crack propagated mainly along deformed-banded microstructure. • Lower failure strength manifested at pipeline steel surface compared to the mid-thickness. • Greater fraction of martensite/austenite constituents featured in specimen WG relative to specimen WH. • Early onset of cracking in specimen WH showed no preference to specific crystallographic orientation. • Multi-component inclusion particle was revealed along crack propagation path. - Abstract: Thermomechanical treatments offer an innovative means of controlling microstructure development and improving resistance to hydrogen induced cracking (HIC) in pipeline steel. This study was conducted on two X70 pipeline steels (labelled WG and WH) of the same chemical composition, but processed with different thermomechanical parameters. Specimen WG was hot rolled at a higher temperature range of 880–820 {sup °}C, while specimen WH was hot rolled between 830 and 760 {sup °}C before cooling at a rate of 25 {sup °}C/s. Early onset of HIC was observed in specimen WH after electrochemical hydrogen charging for 12 h in a solution of 0.2 M H{sub 2}SO{sub 4} and 3 g/l NH{sub 4}SCN, without any applied stress. Also, test pieces from the surface and mid-thickness layers of each pipeline steel were subjected to slow strain rate tensile (SSRT) test with in-situ hydrogen charging. Characterization techniques such as Optical Microscopy, Scanning Electron Microscopy, Electron Backscattered Diffraction and X-ray Diffraction were used to investigate the structure pipeline steel specimens. The role of inclusions on HIC was studied by Energy Dispersive X-ray Spectroscopy. Although the microstructure of both specimens were predominantly ferritic, more martensite/retained austenite (M/A) constituents featured in WG. Further crystallographic texture analysis indicates that grain orientation at the surfaces of both test specimens were similar with deviations towards <111> on the inverse pole figure (IPF); whereas, pole intensity at the mid-thickness deviated towards the <001> direction. Considering the increased fraction of banded-deformed grains with high stored energy, the lower HIC resistance of specimen WH in comparison to specimen WG was justified.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Adaptive model tuning studies for non-invasive diagnostics and feedback control of plasma wakefield acceleration at FACET-II

Beam-driven plasma wakefield acceleration (PWFA) achieves the same energy gain in a single meter, for which conventional accelerators require several kilometers, however much work is still required to match the beam quality of conventional accelerators. The PWFA processes to be studied at the FACET-II facility will utilize extremely short (down to a few fs) high energy (10 GeV), high charge (few nC) electron and eventually positron bunches. The PWFA process is extremely sensitive to the detailed longitudinal current profiles of these bunches and it would be of great benefit to have precise measurement and control of these profiles. We present an adaptive model tuning technique for FACET-II to adaptively tune online models based on real time accelerator and beam data to continuously provide a non-invasive diagnostic which predicts the longitudinal phase space (LPS) of extremely short and highly compressed electron beams, which otherwise require destructive X-band transverse deflecting cavity (XTCAV)-based measurements. Based on simulation studies, our method has the potential for: (1). The development of a non-invasive longitudinal phase space diagnostic by adaptively tuning models based on non-invasive measurements such as energy spread spectra which could be recorded at all of the bunch compressors in the facility. (2). Utilize these diagnostic to perform model-independent feedback-based to achieve desired longitudinal phase space distributions. (3). Utilize the model-independent feedback approach to maximize energy gain while minimizing emittance growth and energy gain variance of the PWFA process by tuning accelerator parameters, while monitoring what longitudinal phase space the algorithm has found, information that will be useful for further analytical and simulation studies.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2022

Enhancement of Two Heterogeneous Reactions in the Production of the Medical Isotope 188 W

We report the efficiency of heterogeneous reactions is influenced by kinetic conditions with an emphasis on reactants in different phases to have effective interactions. Optimal interactions of reactants rely on the rational design of the equipment and engineering parameters for the reaction process, especially for the process on a large scale. 188 W production at the Oak Ridge National Laboratory is such an example. In processing the irradiated 186 W metal target for the 188 W product, two of the heterogeneous reactions are essential ones: (1) the gas–solid reaction of O 2 + W to form WO 3 and (2) the gas–liquid reaction of OsO 4 being absorbed by the NaOH sorbent. Better understanding of the two reactions has led to revisions to the design of the quartz reaction vessel (gas–solid reaction) and the scrubbing system (gas–liquid reaction). The optimized quartz vessel resulted in less heating hours, whereas a more efficient OsO 4 scrubbing system ensured that all volatile OsO 4 was qualitatively captured.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Low Threshold Voltages Electrochemically Drive Gold Migration in Halide Perovskite Devices

The constituent ions of halide perovskite materials are mobile in the solid state and known to participate in reduction/oxidation reactions. Yet few parameters related to electrochemical processes occurring within devices have been carefully determined. Here, we characterize such reactions in model MAPbI3 perovskite devices, and we quantify threshold voltages for key reactions. Gold is oxidized and mobilized under nitrogen, in the dark, at the MAPbI3/Au interface at 0.8 V. When this interface is buffered with the organic hole transport material (HTM), 2,2',7,7'-tetrakis(N,N-di-p-methoxyphenylamino)-9,9'-spirobifluorene, MAPbI3 begins to degrade at 1.2 V; degradation liberates ions that subsequently enable Au migration. Thresholds are insensitive to MAPbI3 thickness or choice of organic HTM or oxide cathode, which suggests that these reactions are driven electrochemically; the electric field across the device is less important. These results have profound implications for understanding in operando degradation pathways of optoelectronic perovskite devices that are varied in terms of interface structures, active material compositions, and ranges of external stressors.

42 ENGINEERING↗
DOE OSTI2021

Automating Bayesian inference and design to quantify acoustic particle levitation

Self-propulsion of micro- and nanoparticles powered by ultrasound provides an attractive strategy for the remote manipulation of colloidal matter using biocompatible energy inputs. Quantitative understanding of particle motion and its dependence on size, shape, and composition requires accurate characterization of the acoustic field, which depends sensitively on the experimental setup. Here, we show how automated experiments based on Bayesian inference and design can accurately and efficiently characterize the acoustic field within resonant chambers used to propel acoustic nanomotors. Repeated cycles of observation, inference, and design (OID) are guided by a physical model that describes the rate at which levitating particles approach the nodal plane. Using video microscopy, we observe the relaxation of tracer particles to this plane following the application of the acoustic field. We use sequential Monte Carlo methods to infer model parameters such as the amplitude and frequency of the resonant chamber while accounting for particle-level measurement noise and population-level heterogeneity in the field. Guided by simulated outcomes, we select the optimal design for the next experiment as to maximize the information gain in the relevant parameters. We show how this iterative process serves to discriminate between competing hypotheses and efficiently converges to accurate parameter estimates using only few automated experiments. We discuss the need for model criticism to ensure the validity of the guiding model throughout automated cycles of observation, inference, and design. Furthermore, this work demonstrates how Bayesian methods can learn the parameters of nonlinear, hierarchical models used to describe video microscopy data of active colloids.

42 ENGINEERING↗
DOE OSTI2021

Causality, intermittence, and crossphase evolution during confinement transitions in the TJ-II stellarator

In this work, we study spontaneous electron to ion root transitions in TJ-II using Langmuir probes. By scanning the probe position on a shot to shot basis, we reconstruct a spatiotemporal map of the evolution of important turbulent quantities in the plasma edge region. We pay particular attention to the evolution of the cross phase between transport-relevant variables, showing the spatiotemporal evolution of this quantity for the first time, revealing the outward propagation of the changes associated with the transition. Additionally, we also compute the intermittence parameter, which allows us to conclude that the turbulence, although its amplitude increases, condenses in a reduced number of dominant modes and becomes less bursty. The causal relationship between variables is studied using the transfer entropy, clarifying the interactions between the main variables and offering a rather complete picture of the complex evolution of the plasma across the confinement transition.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗