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At least 1,711 records · Page 95

Element orbitals for Kohn-Sham density functional theory

We present a method to discretize the Kohn-Sham Hamiltonian matrix in the pseudopotential framework by a small set of basis functions automatically contracted from a uniform basis set such as planewaves. Each basis function is localized around an element, which is a small part of the global domain containing multiple atoms. We demonstrate that the resulting basis set achieves meV accuracy for 3D densely packed systems with a small number of basis functions per atom. The procedure is applicable to insulating and metallic systems.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Quantum computing and preconditioners for hydrological linear systems

Modeling hydrological fracture networks is a hallmark challenge in computational earth sciences. Accurately predicting critical features of fracture systems, e.g. percolation, can require solving large linear systems far beyond current or future high performance capabilities. Quantum computers can theoretically bypass the memory and speed constraints faced by classical approaches, however several technical issues must first be addressed. Chief amongst these difficulties is that such systems are often ill-conditioned, i.e. small changes in the system can produce large changes in the solution, which can slow down the performance of linear solving algorithms. We test several existing quantum techniques to improve the condition number, but find they are insufficient. We then introduce the inverse Laplacian preconditioner, which improves the scaling of the condition number of the system from O(N) to O($\sqrt{N}$) and admits a quantum implementation. These results are a critical first step in developing a quantum solver for fracture systems, both advancing the state of hydrological modeling and providing a novel real-world application for quantum linear systems algorithms.

97 MATHEMATICS AND COMPUTING↗

WARM ABSORBERS AND OUTFLOWS IN THE SEYFERT-1 GALAXY NGC 4051

We present both phenomenological and more physical photoionization models of the Chandra/HETG spectra of the Seyfert-1 active galactic nucleus NGC 4051. We detect 40 absorption and emission lines, encompassing highly ionized charge states from O, Ne, Mg, Si, S, and the Fe L-shell and K-shell. Two independent photoionization packages, XSTAR and Cloudy, were both used to self-consistently model the continuum and line spectra. These fits detected three absorbing regions in this system with densities ranging from 10{sup 10} to 10{sup 11} cm{sup -3}. In particular, our XSTAR models require three components that have ionization parameters of log ({xi}) = 4.5, 3.3, and 1.0, and are located within the broad-line region at 70, 300, and 13000 R{sub g} , respectively, assuming a constant wind density. Larger radii are inferred for density profiles which decline with radius. The Cloudy models give a similar set of parameters with ionization parameters of log ({xi}) = 5.0, 3.6, and 2.2 located at 40, 200, and 3300 R{sub g} . We demonstrate that these regions are outflowing from the system, and carry a small fraction of material out of the system relative to the implied mass accretion rate. The data suggest that magnetic fields may be an important driving mechanism.

79 ASTRONOMY AND ASTROPHYSICS↗

Powering the Blue Economy Foundational Research & Development Topics Reliability for Marine Energy Power Systems

Ocean observing platforms are deployed across the world’s oceans to collect meteorological and oceanographic data. Current technology makes use of solar panels and battery banks to provide power to these platforms, which can be challenging at high latitudes due to lack of solar insolation and cold temperatures. Marine renewable energy (MRE) generation offers a potential improvement in consistent power generation throughout the year for this use on ocean observation buoys. This report analyzes existing reliability of high latitude coastal weather buoys and tsunami detection buoys to determine performance standards that MRE generation sources must meet to become viable power sources for these remote systems. Using measurements recorded from the U.S. National Data Buoy Center’s coastal weather buoys and tsunami detection buoys, the analysis calculated the historic data availability – or the percentage of time a measurement is recorded – to evaluate the reliability of ocean observation buoys. The results show that coastal weather buoys operate at 74% data availability and the tsunami detection systems operate at an average 72% data availability. The results describe the total reliability of the system, including many different types of failures not associated with the power system such as mooring failures or equipment failures caused by extreme weather. Power system outages may only account for a small portion of the system failures. Reliability is an important design criterion for the power system of ocean observation platforms. Future power systems that would be designed for these buoys, such as an MRE generator, need to have a minimum reliability of 72% and 74% to meet the overall performance of the weather buoys and tsunami buoys, respectively. However, power system reliability likely needs to be much higher than overall system reliability, so that power system outages do not negatively impact the overall performance of the buoy.

42 ENGINEERING↗

Real-Time Wireless Data Acquisition System

Current and future aerospace requirements demand the creation of a new breed of sensing devices, with emphasis on reduced weight, power consumption, and physical size. This new generation of sensors must possess a high degree of intelligence to provide critical data efficiently and in real-time. Intelligence will include self-calibration, self-health assessment, and pre-processing of raw data at the sensor level. Most of these features are already incorporated in the Wireless Sensors Network (SensorNet(TradeMark)), developed by the Instrumentation Group at Kennedy Space Center (KSC). A system based on the SensorNet(TradeMark) architecture consists of data collection point(s) called Central Stations (CS) and intelligent sensors called Remote Stations (RS) where one or more CSs can be accommodated depending on the specific application. The CS's major function is to establish communications with the Remote Stations and to poll each RS for data and health information. The CS also collects, stores and distributes these data to the appropriate systems requiring the information. The system has the ability to perform point-to-point, multi-point and relay mode communications with an autonomous self-diagnosis of each communications link. Upon detection of a communication failure, the system automatically reconfigures to establish new communication paths. These communication paths are automatically and autonomously selected as the best paths by the system based on the existing operating environment. The data acquisition system currently under development at KSC consists of the SensorNet(TradeMark) wireless sensors as the remote stations and the central station called the Radio Frequency Health Node (RFHN). The RFF1N is the central station which remotely communicates with the SensorNet(TradeMark) sensors to control them and to receive data. The system's salient feature is the ability to provide deterministic sensor data with accurate time stamps for both time critical and non-time critical applications. Current wireless standards such as Zigbee(TradeMark) and Bluetooth(Registered TradeMark) do not have these capabilities and can not meet the needs that are provided by the SensorNet technology. Additionally, the system has the ability to automatically reconfigure the wireless communication link to a secondary frequency if interference is encountered and can autonomously search for a sensor that was perceived to be lost using the relay capabilities of the sensors and the secondary frequency. The RFHN and the SensorNet designs are based on modular architectures that allow for future increases in capability and the ability to expand or upgrade with relative ease. The RFHN and SensorNet sensors .can also perform data processing which forms a distributed processing architecture allowing the system to pass along information rather than just sending "raw data points" to the next higher level system. With a relatively small size, weight and power consumption, this system has the potential for both spacecraft and aircraft applications as well as ground applications that require time critical data.

Valencia, Emilio J.↗

Estimation of position resolution for DOI-PET detector using diameter 0.2 mm WLS fibers

We have been developing sub mm resolution and $ 1 million DOI-PET detector using wavelength shifting fibers (WLSF), scintillation crystals of plate shape and SiPM (MPPC: HAMAMATSU K. K.). Conventional design of DOI-PET detector is obtained about mm{sup 3} of resolution by using some blocks detecting gamma-ray in mm 3 voxel. It requires the production cost of $ a few ten million or more for high technique of processing crystal and a lot of number of photo-devices, and this technology is reaching the limit of the resolution. Both higher resolution and lower cost of DOI-PET detector production is challenging for PET diagnosis population. We propose two type of detector. One is a whole body PET system, and the other for brain or small animal. Both PET system consist 6 blocks. the former consist of 6 layers 300 mm x 300 mm x 4 mm crystal plate. The latter consist 16 crystal layers, 4 x 4 crystal array. The size of crystal plate is 40 mm x 40 mm x 1 mm.The WLSF sheets connect to upper and lower plane. The whole PET systems connect 8 SiPMs are bonded on each side. For the brain PET, 9 WLSF fibers are bond on the each side. The expected position resolution maybe less than 1 mm at the former. We have estimation experimental performance the system using {sup 22}Na radioactive source. The collection efficiency of WLSF (R-3) sheet was achieved 10% with GAGG at 511 keV. The relation between reconstruction position and incident position is obtained linearity and achieved the resolution of 0.7 mm FWHM for x-axis of DOI by readout WLSF. (authors)

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Design and Operation of an Electric Peaking/Industrial Steam Production Unit for SMRs

Various methods of Thermal Energy Storage (TES) can be coupled to nuclear (or renewable) power sources to help absorb grid variability caused by daily load demand changes and renewable intermittency. Our previous research has shown that coupling a sensible heat TES system to a Small Modular Reactor (SMR) allows the reactor to run at effectively nominal full power during periods of variable electric demand by bypassing steam to the TES system during periods of excess capacity. In this paper we demonstrate that this stored thermal energy can be recovered; allowing the TES system to act as a peaking unit during periods of high electric demand, or used to produce steam for ancillary applications such as desalination. For both applications the reactor can operate continuously at approximately 100% power.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

An Approach to Evaluating the Impact of Small-Core Turbofan Technologies on Engine and Aircraft Performance

NASA’s Hybrid Thermally Efficient Core (HyTEC) project aims to accelerate the development of small-core turbofan engine technologies to enable a fuel burn reduction of 5 to 10 percent for next-generation aircraft, compared to 2020s best-in-class technology. This paper presents a demonstration of methods for evaluating the potential performance impact of small-core engine technologies developed under Phase 1 of the HyTEC project. The approach involves model-based systems analysis, where small-core innovations are integrated into baseline turbofan and aircraft systems models, creating a notional vision system. Performance of the vision system is examined at both the engine and vehicle level. The examined performance metrics include: engine bypass ratio, overall pressure ratio, high pressure compressor exit corrected mass flow, and aircraft fuel burn. The CFM LEAP-1B28 and Boeing 737 MAX 8 are chosen as the baseline state-of-the-art systems. Preliminary results map a design space for the small-core vision system and quantify the distinct effects of technologies on the key metrics.

Michael A Bennett↗

An Approach to Evaluating the Impact of Small-core Turbofan Technologies on Engine and Aircraft Performance

NASA’s Hybrid Thermally Efficient Core (HyTEC) project aims to accelerate the development of small-core turbofan engine technologies to enable a fuel burn reduction of 5 to 10 percent for next-generation aircraft, compared to 2020s best-in-class technology. This paper presents a demonstration of methods for evaluating the potential performance impact of small-core engine technologies developed under Phase 1 of the HyTEC project. The approach involves model-based systems analysis, where small-core innovations are integrated into baseline turbofan and aircraft systems models, creating a notional vision system. Performance of the vision system is examined at both the engine and vehicle level. The examined performance metrics include: engine bypass ratio, overall pressure ratio, high pressure compressor exit corrected mass flow, and aircraft fuel burn. The CFM LEAP-1B28 and Boeing 737 MAX 8 are chosen as the baseline state-of-the-art systems. Preliminary results map a design space for the small-core vision system and quantify the distinct effects of technologies on the key metrics.

Michael Bennett↗

Modulation of the electronic property of phosphorene by wrinkle and vertical electric field

The electronic properties of wrinkled phosphorene and its response to charge injection and external vertical electric field have been studied using first-principles calculations. It is found that small-size wrinkle systems have lower energy than wrinkle-free monolayer, suggesting that free-standing phosphorene spontaneously forms small protrusion on its nanosheet. The ratio of wrinkle height to curvature radius increases with enlarging height, indicating a promotion of field enhancement factor. Furthermore, the injected charges mostly distribute at peak and valley. Direct-to-indirect band-gap transition has been found for zigzag wrinkle with height of 14.81 Å. The band gaps of wrinkled nanosheets decrease almost linearly with increasing field, which is caused by charge separation of valence band maximum and conduction band minimum.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Chimera states in coupled Kuramoto oscillators with inertia

The dynamics of two symmetrically coupled populations of rotators is studied for different values of the inertia. The system is characterized by different types of solutions, which all coexist with the fully synchronized state. At small inertia, the system is no more chaotic and one observes mainly quasi-periodic chimeras, while the usual (stationary) chimera state is not anymore observable. At large inertia, one observes two different kind of chaotic solutions with broken symmetry: the intermittent chaotic chimera, characterized by a synchronized population and a population displaying a turbulent behaviour, and a second state where the two populations are both chaotic but whose dynamics adhere to two different macroscopic attractors. The intermittent chaotic chimeras are characterized by a finite life-time, whose duration increases as a power-law with the system size and the inertia value. Moreover, the chaotic population exhibits clear intermittent behavior, displaying a laminar phase where the two populations tend to synchronize, and a turbulent phase where the macroscopic motion of one population is definitely erratic. In the thermodynamic limit, these states survive for infinite time and the laminar regimes tends to disappear, thus giving rise to stationary chaotic solutions with broken symmetry contrary to what observed for chaotic chimeras on a ring geometry.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

FY 2014 Sodium-Supercritical CO 2 Interactions in the SNAKE Experiment Facility

One appealing feature of the supercritical carbon dioxide Brayton cycle energy conversion system is the small footprint that the hardware requires, which is in part due to the use of compact diffusion-bonded heat exchangers such as Printed Circuit Heat Exchanger (PCHEs) or Hybrid Heat Exchangers (H 2 X) as the heat source heat exchanger (sodium-to-CO 2 ) as well as the recuperator and cooler modules. Although PCHEs and H 2 Xs have a high degree of structural integrity, the potential for leaks to develop between the sodium and CO 2 coolant channels in the heat exchanger cannot be ruled out, and this would lead to discharge of high pressure CO 2 into the secondary coolant circuit. Due to the robustness of the PCHE design, catastrophic failure leading to CO 2 jet blowdown into the secondary sodium loop is not deemed likely. Rather, small cracks (or micro-leaks) may develop in which CO 2 will bleed into the secondary system at a relatively low rate and chemically react with the sodium. The goal of the sodium-CO 2 interaction tests is to gain a fundamental understanding of sodium-CO 2 interactions under prototypical conditions of compact diffusion-bonded heat exchanger failure, a fundamental understanding of self-plugging if it occurs, and the development of one-dimensional phenomenological models for the interactions between high-pressure CO 2 issuing into liquid sodium from a micro-leak across a stainless steel pressure boundary. These models will be validated using experiment data. Therefore, an experiment program at Argonne was initiated in Fiscal Year 2010 to investigate the reaction behavior between sodium and CO 2 under micro-leak conditions. Several reports have described the facility scaling rationale and design. Assembly of the SNAKE (S-CO 2 , Na Kinetics Experiment) began in Fiscal Year 2011 and was completed in July 2012. The sodium inventory in this facility consists of approximately 44 lbs (20 kg; ~21 L/5.5 gal).

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Description of the First Observed Sodium-C0 2 Reactions in the Sodium CO 2 Interaction Experiment (SNAKE)

One appealing feature of the supercritical carbon dioxide Brayton cycle energy conversion system is the small footprint that the hardware requires, which is in part due to the use of Printed Circuit Heat Exchangers (PCHEs) as the heat source heat exchanger (sodium-to-CO 2 ) as well as the recuperator and cooler modules. Although PCHEs have a high degree of structural integrity, the potential for leaks to develop between the sodium and CO 2 coolant channels in the secondary heat exchanger cannot be ruled out, and this would lead to discharge of high pressure CO 2 into the secondary coolant circuit. Due to the robustness of the PCHE design, catastrophic failure leading to CO 2 jet blowdown into the secondary sodium loop is not deemed likely. Rather, small cracks (or micro-leaks) may develop in which CO 2 will bleed into the secondary system at a relatively low rate and chemically react with the sodium. The goal of the sodium-CO 2 interaction tests is to gain a fundamental understanding of sodium-CO 2 interactions under prototypical conditions of compact diffusion-bonded heat exchanger failure, a fundamental understanding of self-plugging if it occurs, and the development of one-dimensional phenomenological models for the interactions between high-pressure CO 2 issuing into liquid sodium from a micro-leak across a stainless steel pressure boundary. These models will be validated using experiment data. Therefore, an experiment program at Argonne was initiated in Fiscal Year 2010 to investigate the reaction characteristics between sodium and CO 2 under micro-leak conditions. Several reports have described the facility scaling rationale and design. Assembly of the SNAKE (S-CO 2 , Na Kinetics Experiment) began in Fiscal Year 2011 and was completed in July 2012. Approximately 44 lbs (20 kg; ~21 L/5.5 gal) of sodium was transferred into the SNAKE dump tank from a drum of clean sodium in July 2012.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

Unfolding the air vanes on a supersonic air-launched missile

ASALM (Advanced Strategic Air-Launched Missile) is a supersonic air vehicle designed to be air-launched from a carrier aircraft. The four aft aerodynamic control vanes are folded to maximize the number of missiles carried on-board. The unfolding (erection) system must be small, energetic, fast, and strong. The materials selected and problems that arose during development of the unfolding system are described.

Wohltmann, M.↗

Advanced Vapor-Supply Manifold

Advanced vapor-supply manifold solves problem of manifold purging. Design virtually eliminates dead gas volumes in manifold system. System incorporates special valve into manifold in way that leaks and contamination problems of previous systems, which use tees and three-port valves, are minimized or eliminated in both main manifold line and in supply line. Of considerable use in gas manifold systems where even small amounts of gaseous impurities constitute problem or where more than one gaseous material used in single system.

Clark, I. O.↗

Texstar: The all-Texas educational satellite system

Longhorn Satellite Company (LSC) has designed Texstar, and educational satellite communications system which will be considered as a means of equalizing the distribution of educational resources throughout the state of Texas. Texstar will be capable of broadcasting live lectures and documentaries in addition to transmitting data from a centralized receiving-transmitting station. Included in the design of Texstar is the system and subsystem design for the satellite and the design of the ground stations. The launch vehicle used will be the Texas-built Conestoga 421-48. The Texstar system incorporates three small satellites in slightly inclined geosynchronous orbits. Due to the configuration and spacing of these satellites, the system will be accessed as if it were one large, geostationary satellite. Texstar is shown to be a viable option to the educational crisis in the state of Texas.

Source record↗

Electrical Power Systems for NASA's Space Transportation Program

Marshall Space Flight Center (MSFC) is the National Aeronautics and Space Administration's (NASA) lead center for space transportation systems development. These systems include earth to orbit launch vehicles, as well as vehicles for orbital transfer and deep space missions. The tasks for these systems include research, technology maturation, design, development, and integration of space transportation and propulsion systems. One of the key elements in any transportation system is the electrical power system (EPS). Every transportation system has to have some form of electrical power and the EPS for each of these systems tends to be as varied and unique as the missions they are supporting. The Preliminary Design Office (PD) at MSFC is tasked to perform feasibility analyses and preliminary design studies for new projects, particularly in the space transportation systems area. All major subsystems, including electrical power, are included in each of these studies. Three example systems being evaluated in PD at this time are the Liquid Fly Back Booster (LFBB) system, the Human Mission to Mars (HMM) study, and a tether based flight experiment called the Propulsive Small Expendable Deployer System (ProSEDS). These three systems are in various stages of definition in the study phase.

Lollar, Louis F.↗

The system with zwitterionic lactose-based surfactant for complexation and delivery of small interfering ribonucleic acid—A structural and spectroscopic study

Systems suitable for the effective preparation of complexes with siRNA (small interfering RNA) are at the center of interest in the area of research work on the delivery of the RNA-based drugs (RNA-therapeutics). This article presents results of a study on the structural effects associated with siRNA complexation by a surfactant comprising a lactose group (N-(3-propanesulfone)-N-dodecyl-amino-beta-D-lactose hydrochloride, LA12). The double stranded siRNA oligomer (21 base pairs) used in this study is responsible for silencing a gene that can be important in the therapy of myotonic dystrophy type 1. The obtained siRNA/LA12 lipoplexes were studied using the methods of small angle scattering of synchrotron radiation, circular dichroism spectroscopy, Fourier transform infrared spectroscopy, and electrophoretic mobility tests. Lipoplexes form in solution stable lamellar or cubic phases. The surfactant selected for the study shows much lower cytotoxicity and good complexation abilities of siRNA than dicationic or polycationic surfactants.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗