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DOE OSTI2014

Chemical Degradation Studies on a Series of Dithiophosphinic Acids

A significant increase in the stability of a series of dithiophosphinic acids (DPAHs) under oxidizing acidic conditions was achieved. The degradation behavior of a series of DPAHs, designed for lanthanide/actinide separation, was examined. The stability of the DPAHs, when contacted with varying nitric acid concentrations, was tested and monitored using 31P {1H} NMR. Changes in the functional groups of the DPAHs resulted in substantial increases in the stability. However, when placed in contact with 2 M HNO3 all the DPAHs eventually showed signs of degradation. The addition of a radical scavenger, hydrazine, inhibited the degradation of the DPAHs. In the presence of a small concentration of hydrazine, five of the DPAHs remained stable for over a month in direct contact with 2 M HNO3.

99 GENERAL AND MISCELLANEOUS↗

DOE OSTI2014

Synthesis, characterization and antibacterial study of tripodal tris-(N-benzoylthioureido)ethylamine

A new tripodal tris-(N-benzoylthiouredoethyl)amine has been successfully synthesized and characterized by spectroscopic technique such as FTIR, ESI MS, {sup 1}H and {sup 13}C NMR. The microanalysis data is in a good agreement with the expected molecular formula. The {sup 1}H NMR chemical shift for both amide and thioamide proton are at lower field than their normal value indicates the presence of the hydrogen bond between the carbonyl oxygen atom and thioamide hydrogen. This is possible when the benzoyl group adopt a trans configuration againts thione group along the C-N bond. The compound has been tested for antibacterial activity against three selected bacteria namely Staphylococcus aureus, Proteus vulgaris and Pseudomanas aeroginosa but there is no significant activities observed.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2015

Binary frequencies in a sample of globular clusters. II. Sample analysis and comparison to models

Binary stars are predicted to have an important role in the evolution of globular clusters, so we obtained binary fractions for 35 globular clusters that were imaged in the F606W and F814W with the Advanced Camera for Surveys on the Hubble Space Telescope. When compared to the values of prior efforts, we find significant discrepancies, despite each group correcting for contamination effects and having performed the appropriate reliability tests. The most reliable binary fractions are obtained when restricting the binary fraction to q⩾0.5. Our analysis indicates that the range of the binary fractions is nearly an order of magnitude for the lowest dynamical ages, suggesting that there is a broad distribution in the binary fraction at globular cluster formation. Dynamical effects also appear to decrease the core binary fractions by a factor of two over a Hubble time, but this is a weak relationship. We confirm a correlation from previous work that the binary fraction within the core–radius decreases with cluster age, indicating that younger clusters formed with higher binary fractions. The strong radial gradient in the binary fraction with cluster radius appears to be a consequence of dynamical interactions. It is often not present in dynamically young clusters, but is nearly always present in dynamically old clusters.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2021

Reanalysis of the top-quark pair hadroproduction and a precise determination of the top-quark pole mass at the LHC *

In this study, we calculate the $t\bar{t}$ pQCD production cross-section at the NNLO and determine the top-quark pole mass from recent measurements at the LHC at the center-of-mass energy $\sqrt{S}=13$ TeV to a high precision by applying the principle of maximum conformality (PMC). The PMC provides a systematic method that rigorously eliminates QCD renormalization scale ambiguities by summing the nonconformal $\beta$ contributions into the QCD coupling constant. The PMC predictions satisfy the requirements of renormalization group invariance, including renormalization scheme independence, and the PMC scales accurately reflect the virtuality of the underlying production subprocesses. By using the PMC, an improved prediction for the $t\bar{t}$ production cross-section is obtained without scale ambiguities, which in turn provides a precise value for the top-quark pole mass. Moreover, the prediction of PMC calculations that the magnitudes of higher-order PMC predictions are well within the error bars predicted from the known lower-order has been demonstrated for the top-quark pair production. The resulting determination of the top-quark pole mass, $m_t^{\rm{pole}}=172.5\pm1.4$ GeV, from the LHC measurement at $\sqrt{S}=13$ TeV agrees with the current world average cited by the Particle Data Group (PDG). The PMC prediction provides an important high-precision test of the consistency of pQCD and the SM at $\sqrt{S}=13$ TeV with previous LHC measurements at lower CM energies.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2019

Phenotypic redshifts with self-organizing maps: A novel method to characterize redshift distributions of source galaxies for weak lensing

Wide-field imaging surveys such as the Dark Energy Survey (DES) rely on coarse measurements of spectral energy distributions in a few filters to estimate the redshift distribution of source galaxies. In this regime, sample variance, shot noise, and selection effects limit the attainable accuracy of redshift calibration and thus of cosmological constraints. We present a new method to combine wide-field, few-filter measurements with catalogues from deep fields with additional filters and sufficiently low photometric noise to break degeneracies in photometric redshifts. The multiband deep field is used as an intermediary between wide-field observations and accurate redshifts, greatly reducing sample variance, shot noise, and selection effects. Our implementation of the method uses self-organizing maps to group galaxies into phenotypes based on their observed fluxes, and is tested using a mock DES catalogue created from N-body simulations. Here, it yields a typical uncertainty on the mean redshift in each of five tomographic bins for an idealized simulation of the DES Year 3 weak-lensing tomographic analysis of σ Δz = 0.007, which is a 60 per cent improvement compared to the Year 1 analysis. Although the implementation of the method is tailored to DES, its formalism can be applied to other large photometric surveys with a similar observing strategy.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2020

MAFLD identifies patients with significant hepatic fibrosis better than NAFLD

Abstract Background & Aims Diagnostic criteria for metabolic associated fatty liver disease (MAFLD) have been proposed, but not validated. We aimed to compare the diagnostic accuracy of the MAFLD definition vs the existing NAFLD criteria to identify patients with significant fibrosis and to characterize the impact of mild alcohol intake. Methods We enrolled 765 Japanese patients with fatty liver (median age 54 years). MAFLD and NAFLD were diagnosed in 79.6% and 70.7% of patients respectively. Significant fibrosis was defined by FIB‐4 index ≥1.3 and liver stiffness ≥6.6 kPa using shear wave elastography. Mild alcohol intake was defined as <20 g/day. Factors associated with significant fibrosis were analysed by logistic regression and decision‐tree analyses. Results Liver stiffness was higher in MAFLD compared to NAFLD (7.7 vs 6.8 kPa, P = .0010). In logistic regression, MAFLD (OR 4.401; 95% CI 2.144‐10.629; P < .0001), alcohol intake (OR 1.761; 95% CI 1.081‐2.853; P = .0234), and NAFLD (OR 1.721; 95%CI 1.009‐2.951; P = .0463) were independently associated with significant fibrosis. By decision‐tree analysis, MAFLD, but not NAFLD or alcohol consumption was the initial classifier for significant fibrosis. The sensitivity for detecting significant fibrosis was higher for MAFLD than NAFLD (93.9% vs 73.0%). In patients with MAFLD, even mild alcohol intake was associated with an increase in the prevalence of significant fibrosis (25.0% vs 15.5%; P = .0181). Conclusions The MAFLD definition better identifies a group with fatty liver and significant fibrosis evaluated by non‐invasive tests. Moreover, in patients with MAFLD, even mild alcohol consumption is associated with worsening of hepatic fibrosis measures.

Yamamura, Sakura↗

DOE OSTI2014

SU-E-T-55: Biological Equivalent Dose (BED) Comparison Between Permanent Interstitial Brachytherapy and Conventional External Beam Radiotherapy for Prostate Cancer

Purpose: The goal of this research is to calculate and compare the Biological Equivalent Dose (BED) between permanent prostate Iodine-125 implant brachytherapy as monotherapy with the BED of conventional external beam radiation therapy (EBRT). Methods: A retrospective study of 605 patients treated with Iodine-125 seed implant was performed in which physician A treated 274 patients and physician B treated 331 patients. All the Brachytherapy treatment plans were created using VariSeed 8 planning system. The Iodine-125 seed source activities and loading patterns varied slightly between the two physicians. The prescription dose is 145 Gy to PTV for each patient. The BED and Tumor Control Probability (TCP) were calculated based on the TG 137 formulas. The BED for conventional EBRT of the prostate given in our institution in 2Gy per fraction for 38 fractions was calculated and compared. Results: Physician A treated 274 patients with an average BED of 123.92±0.87 Gy and an average TCP of 99.20%; Physician B treated 331 patients with an average BED of 124.87±1.12 Gy and an average TCP of 99.30%. There are no statistically significant differences (T-Test) between the BED and TCP values calculated for these two group patients.The BED of the patients undergoing conventional EBRT is calculated to be 126.92Gy. The BED of the patients treated with permanent implant brachytherapy and EBRT are comparable. Our BED and TCP values are higher than the reported values by TG 137 due to higher Iodine-125 seed activity used in our institution. Conclusion: We calculated the BED,a surrogate of the biological response to a permanent prostate brachytherapy using TG 137 formulas and recommendation. The TCP of better than 99% is calculated for these patients. A clinical outcome study of these patients correlating the BED and TCP values with PSA and Gleason Levels as well as patient survival is warranted.

60 APPLIED LIFE SCIENCES↗

DOE OSTI2015

Full cell study of Diels Alder poly(phenylene) anion and cation exchange membranes in vanadium redox flow batteries

In this paper, we report on the performance of Diels Alder poly(phenylene) membranes in vanadium redox flow batteries. The membranes were functionalized with quaternary ammonium groups to form an anion exchange membrane (QDAPP) and with sulfonic acid groups to form a cation exchange membrane (SDAPP). Both membrane classes showed similar conductivities in the battery environment, suggesting that the ion conduction mechanism in the material is not strongly affected by the moieties along the polymer backbone. The resistance to vanadium permeation in QDAPP was not improved relative to SDAPP, further suggesting that the polarity of the functional groups do not play a significant role in the membrane materials tested. Both QDAPP and SDAPP outperformed Nafion membranes in cycling tests, with both achieving voltage efficiencies above 85% while maintaining 95% coulombic efficiency while at a current density of 200 mA/cm 2 .

25 ENERGY STORAGE↗

DOE OSTI2020

High-Sensitivity Nuclear-Structure Studies of Rare Isotopes and Few-Electron Systems

This final technical report presents the work that was completed during the award period for DE-SC0017649 related to the structure of nuclei for both astrophysics and tests of the Standard Model, namely: Using trapped bare (and few-electron) radioactive ions to probe the nature of elec- troweak decay modes under extreme conditions for structure and astrophysics, Providing experimental nuclear structure guidance to nuclear theory in systems relevant for testing the Standard Model, and Working with the HPGe sub-group of the FRIB decay station collaboration, which includes the technical development of a next-generation γ-ray spectrometer.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2023

Optimal gas cooling with minimal aero-opticaldistortion for next generation high-average-power lasers (Progress report, Year 2)

Next-generation lasers that combine high-peak-power ultrashort pulses with high repetition rates have the potential to efficiently deliver the high-average-power outputs required for inertial fusion energy generation, laser-based particle acceleration, and to generate compact secondary x- and 𝛾-ray radiation sources, among others. The combination of long gain length with high surface-to-volume ratio to remove residual heat makes gas-cooled multi-slab amplifier heads an inherently aperture- and average power scalable technology that enables this new class of solid-state lasers, and their thermal management becomes the most pressing technical challenge. As the index-of refraction depends on the gas density, heat removal from the slab surfaces unavoidably entails scattering of propagated light from regions of high temperature fluctuations. The requirement to maximize convective heat extraction from the gain medium under the constraint of minimum optical aberration of the beam renders amplifier slab cooling a technological challenge at the intersection of aero-optics, fluid-mechanics and heat transfer. The goal of this research is to leverage computational fluid dynamics and aero optics simulations of different levels of fidelity to devise a numerical modeling and optimization framework for gas-cooled multi-slab amplifiers. The project will be conducted in close collaboration with the Advanced Photon Technologies Group at Lawrence Livermore National Laboratory, where a gas-cooled test stand for laser materials and thermal management structures will be developed and installed. The final goal of the collaborative effort is to manufacture and benchmark a physical prototype of an numerically optimized amplifier head design. Measurement data on solid-state and thermo-optical distortions will be used for the validation of the numerical models. The key technical challenge in this multi-objective design problem is that of balancing optimal heat removal with minimal optical distortion. To facilitate computationally efficient design optimization and, at the same time, deepen our basic understanding of the interaction of light with turbulence, a complementary study that combines high and low-fidelity flow simulations and aero-optical models is proposed. Along the lines of these two objectives and solution strategies, the project is organized into two thrusts.

42 ENGINEERING↗

DOE OSTI2024

Multiphysics Simulations of Nanofibrous High Power Targets for the Inference of Failure Modes

Fermilab s High Power Targetry Research and Development (HPT R&D) group have been developing and studying an electrospun nanofiber target concept to support the need for robust targets in future fixed target facilities. These nanofiber mats have demonstrated resistance to radiation damage, and the free motion of the individual fibers is expected to mitigate the cyclic stresses induced by a pulsed, high-power beam. To evaluate the efficacy of this concept, nanofiber mat samples have been sent by the HPT R&D group to the HiRadMat facility at CERN for prototypic thermal shock testing; the outcomes of these experiments show that the survivability of a nanofiber target depends on its construction parameters, in particular the packing density of the fibers. Samples with higher packing densities have consistently been destroyed by exposure to the HiRadMat beam, with a hole at the beam center visible, and layers of nanofibers peeled away from the center hole, whereas samples with lower densities have survived with limited damage. The exact reason for the failure of the higher density targets was unclear at the time of the original experiments, but the results of our recent multiphysics simulations which recreate the experiments support the hypothesis that the expansion and pressurization of the air inside the target after being heated by the pulsed beam is the cause; in a high density nanofiber mat, the motion of air through the pores of the mat is much more restricted, and induces a larger pressure on the fibers, blowing the mat apart. In this talk, we ll share the results of these simulations and discuss how they support this hypothesis.

Asztalos, Will↗

DOE OSTI2026

Risks to the DOW Mission From Global Advanced Energy Adoption

Advanced energy technologies have the potential to enhance energy security and resilience; however, they can introduce new vulnerabilities even as they mitigate existing ones. This dichotomy highlights that both action and inaction carry strategic risks in a contested and logistically complex operating environment. Regardless of U.S. civilian or military adoption of such technologies, key allies and adversaries are on adoption paths that will impact the U.S. military at the tactical, operational, and strategic level. The global adoption of advanced energy technologies presents the potential for both positive and negative consequences for U.S. Department of Defense (DOD) missions in the next 10-20 years. Three categories of risk drivers are presented in this analysis: infrastructure-related, adoption-related, and response-related. Each risk type can generate consequences for DOD, including power disruptions, suboptimal DOD mission performance and operational effectiveness, higher costs and shortages for both legacy and advanced energy technologies, and loss of U.S. influence and strategic deterrent value. Specific impacts could include tactical impacts, operational impacts, and strategic impacts. Mitigation strategies could include energy resource and technology planning, cybersecurity, supply chain resilience, workforce development, exercises and simulations, investments in commercialized technology, operational testing and pilot programs, research into emerging technologies, partnerships and working groups, common standards, budget planning, and repurposing infrastructure.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

DOE OSTI2020

Chemically Cross-Linked Cellulose Nanocrystal Aerogels for Effective Removal of Cation Dye

In this study, porous aerogels were prepared by directional freeze-drying via cross-linking cellulose nanocrystals (CNCs) with poly(methyl vinyl ether-co-maleic acid) (PMVEMA) and poly(ethylene glycol) (PEG). The thermal properties and physical adsorption performance toward cation methylene blue dye of the obtained CNC aerogels were investigated. The maximum degradation temperature was increased from 324°C of CNCs to 355°C of cross-linked CNC aerogels. The dye adsorption isotherm results showed that the maximum methylene blue adsorption capacity of CNC aerogels was 116.2 mg g −1 , according to the Langmuir model, which was mainly due to the electrostatic attractions between negatively charged carboxyl groups or sulfonate groups on the CNC aerogles and cation MB molecules. The reusability test showed that the CNC aerogels contained the same dye adsorption performance in five adsorption/desorption cycles. Overall, this study described an ideal alternative for water purification with high dye adsorption capacity and enhanced physical performance.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1978

Rolling-element fatigue life of AISI M-50 and 18-4-1 balls

Rolling element fatigue studies were conducted with AISI M-50, EFR 18-4-1, and VAR 18-4-1. Groups of 12.7 mm (1/2-in) diameter balls of each material were tested in the five ball fatigue tester. Test conditions included a load of 1540 N (347 lbf) giving a maximum Hertz stress of 5520 MPa (800 000 psi), a shaft speed of 10,700 rpm, and a contact angle of 30 deg. Tests were run at a race temperature of 339 K (150 F) with a type 2 ester lubricant. The rolling element fatigue life of AISI M-50 was not significantly different from that of EFR 18-4-1 or VAR 18-4-1 based on a statistical comparison of the test results.

Parker, R. J.↗

NASA NTRS1977

Observed differences in learning ability of heart rate self-regulation as a function of hypnotic susceptibility

Three groups of eight male and female subjects (aged 20-27 yr) categorized by low and high hypnotic susceptibility were taught to control their heart rates by means of an appropriate autogenic therapy/biofeedback technique. The experimental groups were trained by autogenic therapy and biofeedback, while the control group received only biofeedback. Significant differences are observed in all psychological test scores between subjects of high and low hypnotic susceptibility. The results confirm that (1) there are qualitative and quantitative differences between the performance of individuals with high and low hypnotic susceptibility; (2) interindividual-variability tests yield data relevant to individual performance in visceral learning tasks; (3) the combined autogenic therapy/biofeedback/verbal feedback technique is suitable for conditioning large stable autonomic responses in humans; and (4) this kind of conditioning is effective in eliminating or alleviating physiological reactions to some environmental stressors.

Cowings, P. S.↗

NASA NTRS1980

JANTX1N5615 switching diode

Diodes manufactured by Semtech and Micro Semiconductor were tested. Both sample lots exceeded 50% fail-rate in all groups. Failure analysis was performed for groups 2 and 3.

Source record↗

NASA NTRS1985

Critical Transport Phenomena in Fluid Helium Under Low Gravity

The feasibility of carrying out measurements of certain critical transport properties of pure fluid under conditions of low gravity was studied. These properties are the thermal conductivity, kappa, the shear viscosity zeta and the diffusive relaxation time tau, which are predicted to diverge (tend to infinity) as the liquid-vapor critical point is approached. However, in this critical region, the Earth's gravity effect becomes very important. As the critical point is approached, the gravity effects increasingly distort the results. The reason for this is that the compressibility of the fluid also diverges and under the influence of gravity causes a vertical density gradient in the fluid, which is significant even when very thin fluid layers (typically 1 mm high) are being used. The result is that the temperature dependence of kappa, zeta, and tau tends to flatten off as T sub c is approached instead of continuing to increase, and therefore the predictions from the renormalization group and mode coupling theories cannot be subjected to a satisfactory test.

Meyer, H.↗

NASA NTRS1986

Conceptual definition of a technology development mission for advanced solar dynamic power systems

An initial conceptual definition of a technology development mission for advanced solar dynamic power systems is provided, utilizing a space station to provide a dedicated test facility. The advanced power systems considered included Brayton, Stirling, and liquid metal Rankine systems operating in the temperature range of 1040 to 1400 K. The critical technologies for advanced systems were identified by reviewing the current state of the art of solar dynamic power systems. The experimental requirements were determined by planning a system test of a 20 kWe solar dynamic power system on the space station test facility. These requirements were documented via the Mission Requirements Working Group (MRWG) and Technology Development Advocacy Group (TDAG) forms. Various concepts or considerations of advanced concepts are discussed. A preliminary evolutionary plan for this technology development mission was prepared.

Migra, R. P.↗