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At least 631 records · Page 35

On the state of Mn in Mn{sub x}Zn{sub 1−x}O nanoparticles and their surface modification with isonipecotic acid

Mn-doped ZnO (Mn{sub x}Zn{sub 1−x}O) nanoparticles were synthesized by the co-precipitation method and coated with isonipecotic acid as capping ligand. The structure, composition and morphology of the resulting nanomaterial were investigated by energy disperse X-ray analysis, X-ray diffraction, and transmission electron microscopy data. Such measurements showed that the solid obtained contains 6 at% of Mn and it is formed by a highly crystalline material with 3–5 nm range of crystallite size, and only a small elongation of its cell parameter with respect to undoped ZnO wurtzite unit cell. Information on the state of manganese atom in the Mn{sub x}Zn{sub 1−x}O nanostructures formed was obtained from X-ray photoelectron (XPS) and electron energy loss (EELS) spectroscopies. XPS and EELS spectra are composed of four peaks, corresponding to two species of Mn(II) and signals from Mn(III) and Mn(IV). Such spectral data on the state of Mn in the material studied is consistent with the mapping of Mn distribution observed in recorded transmission electron microscopy images, which reveal presence of clusters of Mn atoms. Only a fraction of doping Mn atoms were found forming a solid solution with the host ZnO structure. The functionalization of the nanoparticles system with Isonipecotic acid shows that this molecule remains anchored to the nanoparticles surface mainly through its N basic site. The availability of free carboxylate groups in the capping molecule was tested by conjugation to type IV horseradish peroxidase. - Graphical abstract: State of Mn atoms in Mn-doped ZnO nanostructures prepared by the precipitation method, their capping with isonipecotic acid and subsequent conjugation to peroxidase. - Highlights: • State of manganese in manganese-doped zinc oxide nanoparticles. • Isonipecotic acid as surface modifier of ZnO nanoparticles. • Peroxidase conjugation to ZnO nanoparticles modified with isonipecotic acid.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A Positive Charge in the Outer Coordination Sphere of an Artificial Enzyme Increases CO 2 Hydrogenation

The protein scaffold around the active site of enzymes is known to influence catalytic activity, but specific scaffold features responsible for favorable influences are often not known. This study focuses on using an artificial metalloenzyme to probe one specific feature of the scaffold, the position of a positive charge in the outer coordination sphere around the active site. Previous work showed that a small molecular complex, [Rh(P Et 2 N glycine P Et 2 )2 ] – , immobilized covalently within a protein scaffold was activated for CO 2 hydrogenation. In this work, using an iterative design where the effect of arginine, histidine, or lysine residues placed in the outer coordination sphere of the catalytic active site were evaluated, we tested the hypothesis that positively charged groups facilitate CO 2 hydrogenation with seven unique constructs. Single-, double-, and triple-point mutations were introduced to directly compare catalytic activity, as monitored by turnover frequencies (TOFs) measured in real time with 1 H NMR spectroscopy, and evaluate related structural and electronic properties. Two of the seven constructs showed a 2- and 3-fold increase relative to the wild type, with overall rates ranging from 0.2 to 0.7 h –1 , and a crystal structure of the fastest of these shows the positive charge positioned next to the active site. A crystal structure of the arginine-containing complex shows that the arginines are positioned near the metal. Molecular dynamics (MD) studies also suggest that the positive charge is oriented next to the active site in the two constructs with faster rates but not in the others and that the positive charge near the active site holds the CO 2 near the metal, all consistent with a positive charge appropriately positioned in the scaffold benefiting catalysis. The MD studies also suggest that changes in the water distribution around the active site may contribute to catalytic activity, while modest structural changes and movement of the complex within the scaffold do not.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Design and Prototyping of a Novel Toroidal Magnet System for MOLLER Experiment at Jefferson Lab

The Thomas Jefferson National Accelerator Facility (JLab) has designed a unique spectrometer system to measure the weak interaction between electrons. The experiment— Measurement of Lepton-Lepton Electroweak Reaction (MOLLER)—requires leveraging the recent 12 GeV electron beam upgrade and will run in JLab for three years. Focusing the signal for the MOLLER experiment requires five water-cooled toroidal magnets, each with unique geometry and with 7-fold symmetry. The five magnets operate in a vacuum and provide the magnetic field required to separate the incident beam electrons scattered from the target electrons (Møller scattering) and protons (elastic e-p scattering) in a liquid hydrogen target. The conceptual design was developed by the MOLLER Collaboration and was given to JLab in the form of amp turns and physical location, with additional physics requirements. This article presents prototyping of the coils and magnet support system and discusses the lessons learned during the process along with the plans for full magnet testing and installation. The JLab Magnet Group along with the MOLLER Collaboration developed the specification document that includes keep out zones to design the set of magnets. JLab contracted the design of the first toroid magnet (TM0) of the magnet system to Massachusetts Institute of Technology. The other four toroid magnets (TM1 through TM4) have been designed by JLab and are in the process of fabrication and assembly. Prototype coils of TM1-TM4 were fabricated by Everson-Tesla Incorporated, PA (USA). Finally, this article presents the unique challenges of the design, alignment, high current density, operating range, high radiation dose, and vacuum environment.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Scheduled Sequential Compressed Spectrum Sensing for Wideband Cognitive Radios

The support for high data rate applications with the cognitive radio technology necessitates wideband spectrum sensing. However, it is costly to apply long-term wideband sensing and is especially difficult in the presence of uncertainty, such as high noise, interference, outliers, and channel fading. In this paper, we propose scheduling of sequential compressed spectrum sensing which jointly exploits compressed sensing (CS) and sequential periodic detection techniques to achieve more accurate and timely wideband sensing. Instead of invoking CS to reconstruct the signal in each period, our proposed scheme performs backward grouped-compressed-data sequential probability ratio test (backward GCD-SPRT) using compressed data samples in sequential detection, while CS recovery is only pursued when needed. This method on one hand significantly reduces the CS recovery overhead, and on the other takes advantage of sequential detection to improve the sensing quality. Furthermore, we propose (a) an in-depth sensing scheme to accelerate sensing decision-making when a change in channel status is suspected, (b) a block-sparse CS reconstruction algorithm to exploit the block sparsity properties of wide spectrum, and (c) a set of schemes to fuse results from the recovered spectrum signals to further improve the overall sensing accuracy. Finally, extensive performance evaluation results show that our proposed schemes can significantly outperform peer schemes under sufficiently low SNR settings.

42 ENGINEERING↗

An Effective Earned Value Management System (EVMS) is a Team Sport

We present a novel framework to assess 27 earned value management system (EVMS) environment factors and investigate their impact on project performance. A study of the EVMS literature, a survey of practitioners, and focus group meetings with 36 EVMS industry and government experts, supported the development of the framework. Focus groups involving 80 practitioners refined and tested it. We analyzed performance data from 35 completed projects/programs representing over US$21.8 billion in total cost; a project demonstrating a positive environment could save up to 25% in cost versus baseline. Practitioners can develop an effective EVMS environment by following the provided guidance.

Aramali, Vartenie↗

Geologic Assessment and Recommended New Well Locations to Improve the Area 25 Potable Water System, Nevada National Security Site

The Mission Support and Test Services, LLC (MSTS) Geoscience Operations Group performed a hydrogeologic study of an area of interest in Area 25 at the request of the MSTS Enterprise Infrastructure Program to identify potential locations for a new water well to replace J-14 Water Well (J-14 WW). Based on limited subsurface hydrogeologic data for the area, geologists developed two options for construction of a new well. Option 1 is to construct the well within approximately 250 feet (ft) of J-14 WW, and Option 2 is to construct the well approximately 1,550 ft north of J-11 Water Well (J-11 WW). Option 1 may be preferred, as the hydrogeology is better understood adjacent to an existing well. A well drilled at the Option 2 location would not have to be as deep as that at the Option 1 location, but the hydrogeologic setting is more uncertain at this greater distance from a verified subsurface geologic data point.

58 GEOSCIENCES↗

OC6 Phase Ia Definition Document: Validation of Nonlinear Hydrodynamic Loading on the DeepCwind Semisubmersible

The objective of OC6 Phase I is to investigate the persistent under-prediction (about 20% on average) of the structural loads in the OC5-DeepCwind floating semisubmersible wind system, as observed within the previous OC5 Phase II project. The OC5 results indicate that much of this under-prediction originates from the low-frequency response of the system at the surge/pitch natural frequencies, resulting from nonlinear hydrodynamic loading and/or overprediction of hydrodynamic damping. This work package therefore focuses on better understanding this low-frequency response behavior, the applicability of computational-fluid-dynamics (CFD) models and engineering-level hydrodynamic models for predicting the nonlinear hydrodynamic loading, and the level of uncertainty in the measured response characteristics. To address these objectives, two experimental campaigns were developed and performed in 2017 and 2018 by a sub-group of the OC5 project: Floating test campaign: A simplified OC5-DeepCwind semisubmersible model (no turbine, rigid tower) was moored to three taut-spring lines and subjected to motion decay and wave tests (regular and irregular waves), during which motion amplitudes of the model were measured (see Figure 1a). The purpose of this test campaign was to examine the repeatability of the low-frequency response of the system to wave excitation and determine the level of uncertainty in the response behavior.Constrained test campaign: The same model, but without the tower present, was fixed to a carriage and subjected to towing, forced oscillation and wave tests (regular and irregular waves), during which forces exerted upon the model were measured (see Figure 1b). The purpose of this test campaign was to examine the hydrodynamic loading contributions by separating the wave excitation and radiation forces. Both model test campaigns were performed in the concept basin of the Maritime Research Institute Netherlands (MARIN) in Wageningen, the Netherlands and the first test was within the framework of the MARINET2 project. Both experimental campaigns were examined within Phase Ia of the OC6 project. The purpose of this report is to supply the needed information to participants of the OC6 project to build and simulate the experimental campaigns.

17 WIND ENERGY↗

Smart, Connected Manufactured Housing Solutions through High-Performance Design. Final CRADA report

This report focuses on HVAC, domestic hot water, and miscellaneous electric loads via voluntary opportunities that may arise from partnerships with utilities, as well as future US Environmental Protection Agency ENERGY STAR and DOE Zero Energy Ready Manufactured Home programs. Phase I of this project has begun the technical dialogue toward developing an implementation plan among DOE’s Oak Ridge National Laboratory, Clayton Manufactured Homes, and US Department of Housing and Urban Development Code manufactured housing stakeholders. These activities have focused on delivering high-performance design through integration of technology. Project tasks include the following: Identifying baseline energy analysis resources opportunities from a variety of DOE and utility stakeholders; Developing a smart home and business solution by leveraging existing utility programs working with Smart Homes Partners resources such as ACE IoT Solutions, Google Nest, and Ecobee; Developing improved smarter ventilation systems with industry ventilation partners such as the Madison Group; Developing improved building science QA/QC testing equipment with manufacturers such as The Energy Conservatory, and supporting other feasible concepts vetted under DOE’s Advanced Buildings Collaborative with Slipstream, reinventing HVAC in manufactured housing; and, Developing smart home short- and long-term viable technical solutions in coordination with Clayton Manufactured Homes in new and/or revitalized community scales for future Phase II prototype demonstrations, which may include design (and perhaps construction) of single-section homes targeting rental property developers and multi-section homes targeting low- to middle-income affordable housing community developers Given the ongoing US Department of Energy (DOE) rulemaking activities, baseline energy analysis assessments of envelope prescriptive and Uo (i.e., the overall thermal energy efficiency of the home in British thermal units per square foot of exterior heat loss/gain surfaces) measures were removed from the scope of Phase I of this project.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Design and Prototyping of a Novel Toroid Magnet System for the MOLLER Experiment at Jefferson Lab

The Thomas Jefferson National Accelerator Facility (JLab) has designed a unique spectrometer system to measure the weak interaction between electrons. The experiment ?Measurement of Lepton-Lepton Electroweak Reaction? (MOLLER) requires leveraging the recent 12 GeV electron beam upgrade and will run in JLab for 3 years. Focusing the signal for the MOLLER experiment requires five water-cooled toroidal magnets, each with unique geometry and with 7-fold symmetry. This system of magnets provides the magnetic field required to separate the incident beam electrons scattered from the target electrons (Møller scattering) and protons (elastic e-p scattering) in a liquid hydrogen target. The conceptual design was developed by the MOLLER collaboration and was given to JLab in the form of amp turns and physical location, with additional physics requirements. This paper presents prototyping of the coils and magnet support system and discusses the lessons learned during the process along with the plans for full magnet testing and installation. The JLab Magnet Group along with the MOLLER collaboration developed the specification document that includes keep out zones to design the set of magnets. JLab contracted the design of the first toroid magnet in the magnet (TM0) to Massachusetts Institute of Technology. The other four toroid magnets (TM1 through TM4) have been designed by JLab and are in the process of fabrication and assembly. Prototype coils of TM1-TM4 have been fabricated by Everson-Tesla Incorporated, PA (USA). The manuscript presents the unique challenges of the design, alignment, high current density, operating range, high radiation dose, and vacuum environment.

Kashy, David↗

Precision Neutrino Oscillation Physics with the Daya Bay and DUNE Experiments

The team supported by this grant made significant contributions to the final results of the Daya Bay Reactor Antineutrino Experiment. This experiment utilized eight identically designed antineutrino detectors positioned at varying distances from six 2.9 GW th nuclear reactors to precisely measure the oscillation parameters that govern antineutrino disappearance at short (<2 km) baselines. Our group played a leading role in the calibration and data quality efforts, both of which have been crucial for all final results. Additionally, we co-led the development of an independent measurement of the neutrino mixing angle θ 13 and the atmospheric mass splitting using a sample of antineutrinos identified via neutron capture on hydrogen. Lastly, we laid the groundwork for a search for seasonal modulation in Daya Bay’s measured muon flux using the final dataset, a result expected to be published soon. Simultaneously, our team ramped up its participation in the Deep Underground Neutrino Experiment (DUNE). This experiment will employ a powerful neutrino beam from Fermilab in Illinois directed to the Homestake mine in South Dakota to address some of the most pressing questions in neutrino physics, including the ordering of neutrino masses and whether neutrinos violate the CP symmetry. Our work focused on the development of the pixelated and modularized Liquid Argon Time-Projection Chamber technology that is being prepared for DUNE’s Near Detector. Our group took responsibility for the development, testing, and maintenance of the firmware for the control boards of the detector’s charge readout system and played an active role in analyzing data produced by the very first fully integrated prototypes.

2x2 Demonstrator↗

Monte Carlo Simulation and Reconstruction: Assessment of Myocardial Perfusion Imaging of Tracer Dynamics With Cardiac Motion Due to Deformation and Respiration Using Gamma Camera With Continuous Acquisition

Purpose: Myocardial perfusion imaging (MPI) with single photon emission computed tomography (SPECT) is routinely used for stress testing in nuclear medicine. Recently, our group extended its potential going from 3D visual qualitative image analysis to 4D spatiotemporal reconstruction of dynamically acquired data to capture the time variation of the radiotracer concentration and the estimated myocardial blood flow (MBF) and coronary flow reserve (CFR). However, the quality of reconstructed image is compromised due to cardiac deformation and respiration. The work presented here develops an algorithm that reconstructs the dynamic sequence of separate respiratory and cardiac phases and evaluates the algorithm with data simulated with a Monte Carlo simulation for the continuous image acquisition and processing with a slowly rotating SPECT camera. Methods: A clinically realistic Monte Carlo (MC) simulation is developed using the 4D Extended Cardiac Torso (XCAT) digital phantom with respiratory and cardiac motion to model continuous data acquisition of dynamic cardiac SPECT with slowly rotating gamma cameras by incorporating deformation and displacement of the myocardium due to cardiac and respiratory motion. We extended our previously developed 4D maximum-likelihood expectation-maximization (MLEM) reconstruction algorithm for a data set binned from a continuous list mode (LM) simulation with cardiac and respiratory information. Our spatiotemporal image reconstruction uses splines to explicitly model the temporal change of the tracer for each cardiac and respiratory gate that delineates the myocardial spatial position as the tracer washes in and out. Unlike in a fully list-mode data acquisition and reconstruction the accumulated photons are binned over a specific but very short time interval corresponding to each cardiac and respiratory gate. Reconstruction results are presented showing the dynamics of the tracer in the myocardium as it continuously deforms. These results are then compared with the conventional 4D spatiotemporal reconstruction method that models only the temporal changes of the tracer activity. Mean Stabilized Activity (MSA), signal to noise ratio (SNR) and Bias for the myocardium activities for three different target-to-background ratios (TBRs) are evaluated. Dynamic quantitative indices such as wash-in (K1) and wash-out (k2) rates at each gate were also estimated. Results: The MSA and SNR are higher with higher TBRs while biases were improved with higher TBRs to less than 10%. The correlation between exhalation-inhalation sequence with the ground truth during respiratory cycle was excellent. Our reconstruction method showed better resolved myocardial walls during diastole to systole as compared to the ungated 4D image. Estimated values of K1 and k2 were also consistent with the ground truth. Conclusion: The continuous image acquisition for dynamic scan using conventional two-head gamma cameras can provide valuable information for MPI. Our study demonstrated the viability of using a continuous image acquisition method on a widely used clinical two-head SPECT system. Our reconstruction method showed better resolved myocardial walls during diastole to systole as compared to the ungated 4D image. Precise implementation of reconstruction algorithms, better segmentation techniques by generating images of different tissue types and background activity would improve the feasibility of the method in real clinical environment.

60 APPLIED LIFE SCIENCES↗

Intracore Natural Circulation Study in the High Temperature Test Facility

The development of the Modular High-Temperature Gas-Cooled Reactor is a significant milestone in advanced nuclear reactor technology. One of the concerns for the reactor’s safe operation is the effects of a loss-of-flow accident (LOFA) where the coolant circulators are tripped, and forced coolant flow through the core is lost. Depending on the steam generator placement, loop or intracore natural circulation develops to help transfer heat from the core to the reactor cavity, cooling system. This paper investigates the fundamental physical phenomena associated with intracore coolant natural circulation flow in a one-sixth Computational Fluid Dynamics (CFD) model of the Oregon State University High Temperature Test Facility (OSU HTTF) following a loss-of-flow accident transient. This study employs conjugate heat transfer and steady-state flow along with an SST k-ω turbulence model to characterize the phenomenon of core channel-to-channel natural convection. Previous studies have revealed the importance of complex flow distribution in the inlet and outlet plenums with the potential to generate hot coolant jets. For this reason, complete upper and lower plenum volumes are included in the analyzed computational domain. CFD results also include parametric studies performed for a mesh sensitivity analysis, generated using the STAR-CCM+ software. The resulting channel axial velocities and flow directions support the test facility scaling analysis and similarity group distortions calculation.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Analysis of responses of cold pressor tests on pilots and executives

Statistical analyses were performed to study the relationship between cold pressor test responses and certain medical attributes of a group of 81 pilots and a group of 466 executives. The important results of this study were as follows: There was a significant relationship between a subject's cold pressor test response and his profession (that is, pilot or executive). The executives' diastolic cold pressor test responses were significantly related to their medical conditions, and their families' medical conditions. Significant relationships were observed between executives' diastolic and systolic cold pressor test responses and their history of tranquilizer and cardiac drug use.

Swaroop, R.↗

Effect of restricted motion in high temperature on enzymatic activity of the pancreas

Effects of 30 day hypodynamia coupled with high temperature (35-36 C) on enzymatic activity of the pancreas of male adult rats were studied. The test animals were divided into four groups. Group one served as controls (freedom of movement and a temperature of 25-26 C, considered optimal). The remaining animals were divided into three additional groups: Group two freedom of movement but high temperature (35-36 C); group three hypodynamia but an optimal temperature; group four hypodynamia and 35-36 C. Considerable change in the enzymatic activity in the pancreas of the four groups is observed in three experimental groups (two, three, and four) as compared to the control (group one). The results indicate that adaption of the organism to the thermal factor and restricted movement is accompanied by a change in the enzymatic spectrum of the pancreas. With the combined effect of these two stresses under conditions of the adaption of the organism especially sharp shifts occur in the enzymatic activity.

Abdusattarov, A.↗

Observations of FK Comae stars

Observations on the FK Comae stars are described. FK Com, UZ Lib and HD 199178 are compared and related as a group of stars. The crucial observational tests of the proposed evolutionary status of these stars are noted.

Bopp, B. W.↗

Thermoregulation in cold- and noncold-acclimated rats cold exposed in hypergravic fields

The effect of hypergravity on thermoregulation processes is investigated experimentally in rats. Hooded male Long-Evans rats were kept for 6 weeks at 5 or 23 C (cold-acclimated and noncold-acclimated groups, CA and NCA) prior to testing. One test protocol comprised sequential 1-h exposures to 23 C at 1 G, 23 C at 3 G (in a 2.1-m radius centrifuge; -Gx), 8 C at 3 G, 8 C at 1 G, and finally 23 C at 1 G, with continuous measurement of the oxygen consumption. In a second protocol, restrained rats were exposed to 23 C at 1 G, 23 C at 3 G, and 10 C at 3 G, and core temperature changes were monitored. The results are presented in graphs and a table. Oxygen consumption doubled in both CA and NCA rats on exposure to cold at 1 G, but at 3 G NCA consumption decreased while CA consumption remained high. The CA rats were also more able to maintain core temperature at 3 G than the NCA rats. These differences are attributed to the nonshivering thermogenic processes developed in CA rats, which appear to be unaffected by hypergravity.

Horowitz, J. M.↗

High power density performance of WPt and WRh electrodes in the alkali metal thermoelectric converter

The properties of the alkali metal thermoelectric converter (AMTEC) are discussed together with those of an efficient AMTEC electrode. Three groups of electrodes were prepared and tested for their performance as AMTEC electrodes, including WPt-T3, WRh-B1, and WRh-B2. The best electrodes of both WPt and WRh types typically exhibited low porosity, and thickness greater than 0.8 micron, which indicated that transport in these electrodes does not occur by a purely free-molecular flow mode. The observed values of the exchange current were found to be within the range of those observed for oxide-free Mo electrodes under similar conditions.

Williams, R. M.↗

Terminal weather information management

Since the mid-1960's, microburst/windshear events have caused at least 30 aircraft accidents and incidents and have killed more than 600 people in the United States alone. This study evaluated alternative means of alerting an airline crew to the presence of microburst/windshear events in the terminal area. Of particular interest was the relative effectiveness of conventional and data link ground-to-air transmissions of ground-based radar and low-level windshear sensing information on microburst/windshear avoidance. The Advanced Concepts Flight Simulator located at Ames Research Center was employed in a line oriented simulation of a scheduled round-trip airline flight from Salt Lake City to Denver Stapleton Airport. Actual weather en route and in the terminal area was simulated using recorded data. The microburst/windshear incident of July 11, 1988 was re-created for the Denver area operations. Six experienced airline crews currently flying scheduled routes were employed as test subjects for each of three groups: (1) A baseline group which received alerts via conventional air traffic control (ATC) tower transmissions; (2) An experimental group which received alerts/events displayed visually and aurally in the cockpit six miles (approx. 2 min.) from the microburst event; and (3) An additional experimental group received displayed alerts/events 23 linear miles (approx. 7 min.) from the microburst event. Analyses of crew communications and decision times showed a marked improvement in both situation awareness and decision-making with visually displayed ground-based radar information. Substantial reductions in the variability of decision times among crews in the visual display groups were also found. These findings suggest that crew performance will be enhanced and individual differences among crews due to differences in training and prior experience are significantly reduced by providing real-time, graphic display of terminal weather hazards.

Lee, Alfred T.↗