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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 OSTI2023

Mechanically induced thermal runaway severity analysis for Li-ion batteries

Thermal runaway is one of the most important safety concerns in the deployment of Li-ion batteries. For this study, we developed a standardized single-side indentation test protocol to induce an internal short-circuit. Cell voltage, temperature, and applied compressive force are monitored as a function of time. Each cell is given an observed hazard severity (OHS in five categories) modified from the EUCAR table. Meanwhile a calculated hazard severity (CHS) is obtained solely based on temperature and voltage curves. The calculation formula considers the cell temperature, rate of temperature increase, cell capacity, state of charge (SOC), voltage drop, and voltage drop rate. Each term is assigned with an appropriate weight to scale the calculated score from 0 to100. This method was applied to >100 Li-ion batteries with various SOCs and chemistries, and their OHS and CHS were displayed against SOC. The purpose is to provide battery designers, manufacturers, and end-users a clear comparison of thermal runaway severity of different batteries.

25 ENERGY STORAGE↗
DOE OSTI2019

Calibration of NMR porosity to estimate permeability in carbonate reservoirs

Considering the performance of carbon dioxide (CO 2 ) stored in geologic reservoirs requires some knowledge of the subsurface heterogeneity, where the most reliable data is extracted from wellbore measurements. This benefit is especially true for carbonate reservoirs were reactions between supercritical CO 2 , the reservoir brine, and carbonate minerals create new storage capacity and enhanced permeability. Techniques like NMR well logging hold promise for estimating subsurface permeability, because the total porosity and pore size can be calculated from response of 1 H NMR signal. Resulting depth profiles of porosity and permeability from downhole logs are useful input for reservoir simulations and can be used to design injection protocols and estimate storage capacity. We conducted a detailed characterization study to quantify the NMR response to matrix pore space, the connectivity to larger vugs and fractures, and the resulting permeability of core samples from distinct carbonate formations. The cores used in study span 5 orders in permeability, 4 orders in mean T 2 , and 2%–42% in porosity. The goal of the study was to use independent measures of pore volumes, surface relaxivity, fluid-accessible surface areas, and permeability to develop carbonate permeability models. It was not possible to develop a single model that reproduced permeability for different carbonate formations, because phenomena specific to the reservoirs could not be extracted even with the state-of-the-art characterization techniques used in this study. Estimates of permeability require calibration. Best calculations for a given formation were achieved by using a simple form of the Kozeny equation (Eq. 6): κ=Α’θ 3*n , and calibrating A’ and n with laboratory measurements made on the formation cores. Empirical calibrations can then be used to map the vertical heterogeneity of the storage complex to better understand the physical movement CO 2 and brine in the subsurface and the positive feedback between mineral dissolution and the development of flow pathways.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2012

Evaluation of flexible and rigid (class solution) radiation therapy conformal prostate planning protocols

Protocols commonly implemented in radiotherapy work areas may be classified as being either rigid (class solution) or flexible. Because formal evaluation of these protocol types has not occurred within the literature, we evaluated the efficiency of a rigid compared with flexible prostate planning protocol by assessing a series of completed 3D conformal prostate plans. Twenty prostate cancer patients with an average age of 70 years (range, 52-77) and sizes comprising 8 small, 10 medium, and 2 large were planned on the Phillips Pinnacle treatment planning system 6 times by radiation therapists with <2 years, 2-5 years, and >5 years of experience using a rigid and flexible protocol. Plans were critiqued using critical organ doses, confirmation numbers, and conformity index. Plans were then classified as being acceptable or not. Plans produced with the flexible protocol were 53% less likely to require modification (OR 0.47, 95% CI: 0.26, 0.84, p = 0.01). Planners with >5 years of experience were 78% more likely to produce plans requiring modification (OR 1.78, 95% CI: 1.12, 2.83, P = 0.02). Plans according to the flexible protocol took longer (112 min) compared with the time taken using a rigid protocol (68 min) (p < 0.001). The results suggest that further studies are needed; however, we propose that all radiation therapy planners should start with the same limitations, and if an acceptable plan is not reached, then flexibility should be given to improve the plan to meet the desired results.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2017

A comprehensive review of metal-induced cellular transformation studies

In vitro transformation assays not only serve practical purposes in screening for potential carcinogenic substances in food, drug, and cosmetic industries, but more importantly, they provide a means of understanding the critical biological processes behind in vivo cancer development. In resemblance to cancer cells in vivo, successfully transformed cells display loss of contact inhibition, gain of anchorage independent growth, resistant to proper cell cycle regulation such as apoptosis, faster proliferation rate, potential for cellular invasion, and ability to form tumors in experimental animals. Cells purposely transformed using metal exposures enable researchers to examine molecular changes, dissect various stages of tumor formation, and ultimately elucidate metal induced cancer mode of action. For practical purposes, this review specifically focuses on studies incorporating As-, Cd-, Cr-, and Ni-induced cell transformation. Through investigating and comparing an extensive list of studies using various methods of metal-induced transformation, this review serves to bridge an information gap and provide a guide for avoiding procedural discrepancies as well as maximizing experimental efficiency. - Highlights: • In vitro transformation studies provide insights for metal-induced carcinogenesis. • Heavily individualized protocols may obscure scientific results and understandings. • This review may be used as reference for avoiding procedural discrepancies.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2013

Estimating water content in an active landfill with the aid of GPR

Highlights: • Limited information in the literature on the use of GPR to measure in situ water content in a landfill. • Developed GPR method allows measurement of in situ water content in a landfill. • Developed GPR method is appealing to waste management professionals operating landfills. - Abstract: Landfill gas (LFG) receives a great deal of attention due to both negative and positive environmental impacts, global warming and a green energy source, respectively. However, predicting the quantity of LFG generated at a given landfill, whether active or closed is difficult due to the heterogeneities present in waste, and the lack of accurate in situ waste parameters like water content. Accordingly, ground penetrating radar (GPR) was evaluated as a tool for estimating in situ water content. Due to the large degree of subsurface heterogeneity and the electrically conductive clay cap covering landfills, both of which affect the transmission of the electromagnetic pulses, there is much scepticism concerning the use of GPR to quantify in situ water content within a municipal landfill. Two landfills were studied. The first landfill was used to develop the measurement protocols, while the second landfill provided a means of confirming these protocols. GPR measurements were initially completed using the surface GPR approach, but the lack of success led to the use of borehole (BH) GPR. Both zero offset profiling (ZOP) and multiple offset gathers (MOG) modes were tried, with the results indicating that BH GPR using the ZOP mode is the most simple and efficient method to measure in situ water content. The best results were obtained at a separation distance of 2 m, where higher the water content, smaller the effective separation distance. However, an increase in water content did appear to increase the accuracy of the GPR measurements. For the effective separation distance of 2 m at both landfills, the difference between GPR and lab measured water contents were reasonable at 33.9% for the drier landfill and 18.1% for the wetter landfill. Infiltration experiments also showed the potential to measure small increases in water content.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2018

Electronic Structure and Dynamics of Copper-Doped Indium Phosphide Nanocrystals Studied with Time-Resolved X-ray Absorption and Large-Scale DFT Calculations

Here, the recent development of time-resolved X-ray absorption spectroscopy (TR-XAS) has opened avenues for fundamental research on doped semiconductors. Reported herein are results on the successful doping of indium phosphide nanocrystals (NCs) with copper and subsequent charactenzation with time-resolved X-ray studies and largescale density functional theory (DFT) calculations. The synthetic protocol that was based on the cluster seed method afforded control of both the doping level and the quantity of NCs produced in a batch. The stability of the colloidal dispersion allowed us to monitor the photophysical properties of copper guest ions with static and TR-XAS at the copper K-edge. These data reveal that copper captures a hole from the photoexcited InP NC, and relaxation to the ground state occurs via multiple timescales likely due to the presence of interior and surface-bound dopant ions as well as recombination with surfaceand defect-trapped electrons. Large-scale DFT calculations reveal a striking dependence of the electronic structure on the ligand coating and other effects such as self-compensation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Two Experimental Protocols for Accurate Measurement of Gas Component Uptake and Production Rates in Bioconversion Processes

Abstract Bioconversion processes offer many economic, environmental, and societal advantages for production of fuels and chemicals. Successful commercialization of any biotechnology usually requires accurate characterization of cell growth dynamics, substrate conversion and production excretion rates. Despite recent advancements in analytical equipment, obtaining accurate measurement of gas component uptake or production rates remains challenging due to their high sensitivity to system pressure or volume changes. Specifically, the consumption and production of various gases will result in changes in system pressure (for batch operations) or off-gas flow rate (for continuous operations). These changes would cause significant errors in the estimated gas component uptake and production rates if they were not accounted for. In this work, we propose two easy-to-implement experimental protocols and associated calculation procedures to obtain accurate measurements of gas component consumption and production rates; one is for batch operation and one is for continuous operation. For depressurized ( i . e ., system pressure below 1 atm) batch cultures, nitrogen (or other inert gases) is used to repressurize the system to 1 atm before taking sample; while for continuous cultures, He (or other inert gases) is used as an internal tracer to accurately measure off-gas flow rate. The effectiveness and accuracy of the two protocols and associated calculation procedures are demonstrated using several case studies with both abiotic and biotic systems.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2013

Summary of ongoing clinical protocols for proton and heavier-ion therapy

Since 1954 when the very first patient was treated at LBNL with heavy-charged particles, some 84,000 patients in total have now been treated with protons, and another 13,000 patients have been treated with carbon and other heavier ions. During the first several decades of this endeavor, particle therapy was accessible only at a small number of programs. More recently, however, this therapy has become available at a rapidly increasing number of facilities worldwide. This expansion of the discipline has led to the development of many more clinical trials, designed to optimize particle-beam therapy and to compare the results achieved with those resulting from other treatment methods. Presently, more than 50 clinical protocols worldwide are actively involved in the effort to improve our understanding of these clinical guidelines. The purpose of this brief review is to offer a broad overview of these protocols, highlighting the specific disease categories that are now being studied using proton and/or heavier-ion therapy, and how the parameters of dose-escalation, beam conformity, and RBE modeling are being evaluated for various disease sites and stages.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2024

Reinforcement expectation in the honeybee ( Apis mellifera ): Can downshifts in reinforcement show conditioned inhibition?

When animals learn the association of a conditioned stimulus (CS) with an unconditioned stimulus (US), later presentation of the CS invokes a representation of the US. When the expected US fails to occur, theoretical accounts predict that conditioned inhibition can accrue to any other stimuli that are associated with this change in the US. Empirical work with mammals has confirmed the existence of conditioned inhibition. But the way it is manifested, the conditions that produce it, and determining whether it is the opposite of excitatory conditioning are important considerations. Invertebrates can make valuable contributions to this literature because of the well-established conditioning protocols and access to the central nervous system (CNS) for studying neural underpinnings of behavior. Nevertheless, although conditioned inhibition has been reported, it has yet to be thoroughly investigated in invertebrates. Here, we evaluate the role of the US in producing conditioned inhibition by using proboscis extension response conditioning of the honeybee (Apis mellifera). Specifically, using variations of a “feature-negative” experimental design, we use downshifts in US intensity relative to US intensity used during initial excitatory conditioning to show that an odorant in an odor–odor mixture can become a conditioned inhibitor. We argue that some alternative interpretations to conditioned inhibition are unlikely. However, we show variation across individuals in how strongly they show conditioned inhibition, with some individuals possibly revealing a different means of learning about changes in reinforcement. We discuss how the resolution of these differences is needed to fully understand whether and how conditioned inhibition is manifested in the honeybee, and whether it can be extended to investigate how it is encoded in the CNS. It is also important for extension to other insect models. In particular, work like this will be important as more is revealed of the complexity of the insect brain from connectome projects.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2021

Bennett-Brassard 1984 quantum key distribution using conjugate homodyne detection

Optical homodyne detection has been widely used in continuous-variable (CV) quantum information processing for measuring field quadrature. In this paper we explore the possibility of operating a conjugate homodyne detection system in “photon counting” mode to implement discrete-variable (DV) quantum key distribution (QKD). A conjugate homodyne detection system, which consists of a beam splitter followed by two optical homodyne detectors, can simultaneously measure a pair of conjugate quadratures X and P of the incoming quantum state. In classical electrodynamics, X 2 + P 2 is proportional to the energy (the photon number) of the input light. In quantum optics, X and P do not commute and thus the above photon-number measurement is intrinsically noisy. This implies that a blind application of standard security proofs of QKD could result in pessimistic performance. We overcome this obstacle by taking advantage of two special features of the proposed detection scheme. First, the fundamental detection noise associated with vacuum fluctuations cannot be manipulated by an external adversary. Second, the ability to reconstruct the photon number distribution at the receiver's end can place additional constraints on possible attacks from the adversary. As an example, we study the security of the BB84 QKD using conjugate homodyne detection and evaluate its performance through numerical simulations. This study may open the door to a family of QKD protocols, complementary to the well-established DV-QKD based on single-photon detection and CV-QKD based on coherent detection.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2011

Discrete-time quantum walk approach to state transfer

We show that a quantum-state transfer, previously studied as a continuous-time process in networks of interacting spins, can be achieved within the model of discrete-time quantum walks with a position-dependent coin. We argue that, due to additional degrees of freedom, discrete-time quantum walks allow one to observe effects which cannot be observed in the corresponding continuous-time case. First, we study a discrete-time version of the engineered coupling protocol due to Christandl et al. [Phys. Rev. Lett. 92, 187902 (2004)] and then we discuss the general idea of conversion between continuous-time quantum walks and discrete-time quantum walks.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2022

Model Assumptions and Data Characteristics: Impacts on Domain Adaptation in Building Segmentation

Studies on domain adaptation (DA) for remote sensing (RS) imagery analysis lack consistency in selection and description of evaluation scenarios. Without properly characterizing datasets, model assumptions, and evaluation scenarios, it is difficult to objectively compare DA methods and reach conclusions about their suitability across different applications. With this motivation, this work seeks to empirically assess to which extent the interaction between data characteristics and model assumptions influences the effectiveness of DA methods. Using the widely explored task of building footprint segmentation as a case study, we perform a large-scale study across over 200 DA scenarios that include variations across view angles, areas observed, and sensors used for data acquisition. Rather than adopting different model architectures or optimization criteria, we contrast the performances of two DA methods based on adversarial learning that differ only in their assumptions about source and target domains. Informed by metadata and data characteristics unveiled using traditional computer vision (CV) techniques as well as pretrained deep models, we provide a detailed meta-analysis of experiments highlighting the importance of accurately considering data assumptions for DA in RS segmentation tasks. As demonstrated by a “cherry-picking” exercise, different claims regarding which model is best could be made by selecting different subsets of evaluation scenarios. While well-calibrated assumptions can be beneficial, mismatching assumptions can lead to negative biases in DA applications. Furthermore, this study intends to motivate the community toward more consistent evaluation protocols while providing recommendations and insights toward creating novel benchmark datasets, documenting data characteristics, application-specific knowledge, and model assumptions.

42 ENGINEERING↗
DOE OSTI2016

SU-F-J-130: Margin Determination for Hypofractionated Partial Breast Irradiation

Purpose: To determine the Planning Target Volume (PTV) margin for Hypofractionated Partial Breast Irradiation (HPBI) using the van Herk formalism (M=2.5∑+0.7σ). HPBI is a novel technique intended to provide local control in breast cancer patients not eligible for surgical resection, using 40 Gy in 5 fractions prescribed to the gross disease. Methods: Setup uncertainties were quantified through retrospective analysis of cone-beam computed tomography (CBCT) data sets, collected prior to (prefraction) and after (postfraction) treatment delivery. During simulation and treatment, patients were immobilized using a wing board and an evacuated bag. Prefraction CBCT was rigidly registered to planning 4-dimensional computed tomography (4DCT) using the chest wall and tumor, and translational couch shifts were applied as needed. This clinical workflow was faithfully reproduced in Pinnacle (Philips Medical Systems) to yield residual setup and intrafractional error through translational shifts and rigid registrations (ribs and sternum) of prefraction CBCT to 4DCT and postfraction CBCT to prefraction CBCT, respectively. All ten patients included in this investigation were medically inoperable; the median age was 84 (range, 52–100) years. Results: Systematic (and random) setup uncertainties (in mm) detected for the left-right, craniocaudal and anteroposterior directions were 0.4 (1.5), 0.8 (1.8) and 0.4 (1.0); net uncertainty was determined to be 0.7 (1.5). Rotations >2° in any axis occurred on 8/72 (11.1%) registrations. Conclusion: Preliminary results suggest a non-uniform setup margin (in mm) of 2.2, 3.3 and 1.7 for the left-right, craniocaudal and anteroposterior directions is required for HPBI, given its immobilization techniques and online setup verification protocol. This investigation is ongoing, though published results from similar studies are consistent with the above findings. Determination of margins in breast radiotherapy is a paradigm shift, but a necessary step in moving towards hypofractionated regiments, which may ultimately redefine the standard of care for this select patient population.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2022

Benchmarking Solid-State Batteries Containing Sulfide Separators: Effects of Electrode Composition and Stack Pressure

Integrating sulfide separators into solid-state batteries (SSBs) containing high energy cathodes typically requires one or more materials and engineering solutions including: (i) applying interfacial coatings to mitigate electrolyte decomposition, (ii) applying high stack pressures to form robust solid-solid contacts, and (iii) using alloying anodes to avoid Li dendrite formation. Despite the promise of these approaches, a lack of standardized testing protocols makes it difficult to directly compare results among different studies. To address this problem, the present work benchmarks the performance of SSBs containing β-Li 3 PS 4 (LPS) separators and composite cathodes. By systematically varying the anode/cathode composition and stack pressure, this work demonstrates that cathode design is a major bottleneck for solid-state cells cycled at low rates (<100 µA cm -2 ). Operando stack pressure measurements show that, while mechanical confinement generally promotes higher active material utilization and cycling stability, this strategy alone does not address interfacial reactivity between LPS and high voltage cathodes. Here, these results also demonstrate that stress evolution during cycling is dominated by volume changes at the Li metal anode. Finally, we show that FeS 2 cathodes with moderate operating voltages (<3 V vs Li/Li + ) exhibit superior cycling performance compared to high voltage cathodes by facilitating formation of stable cathode/electrolyte interfaces.

25 ENERGY STORAGE↗
DOE OSTI2021

Protocols for Uranium Carbon Analysis - Testing Protocol Summary

In 1998, Sigma (then MST-6) purchased and installed a new carbon-sulfur analyzer in G105 as part of a substantial refresh of our analytic capabilities. Substantial effort was undertaken to establish analysis protocols for uranium and other materials. This summary describes the following protocols we put in place as a result of these studies: sample xize (for monolithic samples—chip and powder sample may need more current study), flux/accelerant recipe, and sample cleaning process.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Barriers and Alternatives to Encryption in Critical Nuclear Systems

Over the past decade, cybersecurity researchers have released multiple studies highlighting the insecure nature of I&C system communication protocols. In response, standards bodies have addressed the issue by adding the ability to encrypt communications to some protocols in some cases, while control system engineers have argued that encryption within these kinds of high consequence systems is in fact dangerous. Certainly, control system information between systems should be protected. But encrypting the information may not be the best way to do so. In fact, while in IT systems vendors are concerned with confidentiality, integrity, and availability, frequently in that order, in OT systems engineers are much more concerned with availability and integrity that confidentiality. In this paper, we will counter specific arguments against encrypting control system traffic, and present potential alternatives to encryption that support nuclear OT system needs more strongly that commodity IT system needs while still providing robust integrity and availability guarantees.

42 ENGINEERING↗
DOE OSTI2023

Origin and characterization of single-electron events in Skipper-CCDs for light dark matter searches

This manuscript summarizes the work carried out within the SENSEI (Sub-Electron-Noise Skipper-CCD Experimental Instrument) collaboration, an effort focused on the search for light dark matter using Skipper-CCDs. Firstly, it presents the data acquisition and processing protocol developed to establish a selection criteria for events compatible with the dark matter signal. This protocol also enabled the structure and tools used for the study and characterization of phenomena that impact the quality of measurements made in the search for dark matter (measurement of the Fano factor, determination of the Compton background, and characterization of the high-energy surface background), which were carried out during this work. Secondly, it discusses the comprehensive study conducted on the origin of single-electron events in Skipper-CCDs, which allowed for the selection of detector operating parameters and improved the detection sensitivity in the search for dark matter. It is highlighted the characterization of the spatial correlation between single-electron events and high-energy events, among other developed event selection criteria, and the optimization of the output device to reduce sources of luminescence during its operation. As a result of this study, the lowest levels of dark current and spurious charge ever measured in a CCD are reported. Finally, the latest published results from SENSEI are presented. The obtained limits for the scattering of a light mediator are the best reported to date across the entire investigated mass range, while for the heavy mediator, they are the best for masses below 10 MeV. In terms of dark matter absorption, the most restringent limits below 10 eV are reported. These results, achieved with only a very small fraction of the total projected exposure for SENSEI, position Skipper-CCDs as leaders in the search for light dark matter worldwide.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2013

Meta-analyses of studies of the human microbiota

Our body habitat-associated microbial communities are of intense research interest because of their influence on human health. Because many studies of the microbiota are based on the same bacterial 16S ribosomal RNA (rRNA) gene target, they can, in principle, be compared to determine the relative importance of different disease/physiologic/developmental states. However, differences in experimental protocols used may produce variation that outweighs biological differences. By comparing 16S rRNA gene sequences generated from diverse studies of the human microbiota using the QIIME database, we found that variation in composition of the microbiota across different body sites was consistently larger than technical variability across studies. However, samples from different studies of the Western adult fecal microbiota generally clustered by study, and the 16S rRNA target region, DNA extraction technique, and sequencing platform produced systematic biases in observed diversity that could obscure biologically meaningful compositional differences. In contrast, systematic compositional differences in the fecal microbiota that occurred with age and between Western and more agrarian cultures were great enough to outweigh technical variation. Furthermore, individuals with ileal Crohn’s disease and in their third trimester of pregnancy often resembled infants from different studies more than controls from the same study, indicating parallel compositional attributes of these distinct developmental/physiological/disease states. Together, these results show that cross-study comparisons of human microbiota are valuable when the studied parameter has a large effect size, but studies of more subtle effects on the human microbiota require carefully selected control populations and standardized protocols.

59 BASIC BIOLOGICAL SCIENCES↗