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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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At least 901 records · Page 50
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Electronic Excitations in Complex Molecular Environments: Many-Body Green’s Functions Theory in VOTCA-XTP

Many-body Green’s functions theory within the GW approximation and the Bethe-Salpeter Equation (BSE) is implemented in the open-source VOTCA-XTP software, aiming at the calculation of electronically excited states in complex molecular environments. Based on Gaussian-type atomic orbitals and making use of resolution of identity techniques, the code is designed specifically for nonperiodic systems. Application to a small molecule reference set successfully validates the methodology and its implementation for a variety of excitation types covering an energy range from 2 to 8 eV in single molecules. Further, embedding each GW-BSE calculation into an atomistically resolved surrounding, typically obtained from Molecular Dynamics, accounts for effects originating from local fields and polarization. Using aqueous DNA as a prototypical system, different levels of electrostatic coupling between the regions in this GW-BSE/MM setup are demonstrated. Particular attention is paid to charge-transfer (CT) excitations in adenine base pairs. It is found that their energy is extremely sensitive to the specific environment and to polarization effects. The calculated redshift of the CT excitation energy compared to a nucelobase dimer treated in vacuum is of the order of 1 eV, which matches expectations from experimental data. Predicted lowest CT energies are below that of a single nucleobase excitation, indicating the possibility of an initial (fast) decay of such an UV excited state into a binucleobase CT exciton. Furthermore, the results show that VOTCA-XTP’s GW-BSE/MM is a powerful tool to study a wide range of types of electronic excitations in complex molecular environments.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Building morphologies of the USA structures database; a gauntlet feature set

In recent years there has been a proliferation of methods and data to extract building footprints from satellite imagery. However there has been very little effort to provide additional insight about these buildings beyond their spatial location and shape. Features derived from their geometries can be used to better characterize these buildings which are critical for further research and development. In this work a set of 65 unique features for every building for more than 131 million buildings covering the US has been developed. This rich feature dataset will enable researchers, policymakers and various agencies to derive additional building characteristics like height, occupancy type, and help to gain valuable and new insights of the built environment.

Environmental sciences↗
DOE OSTI2015

Kinetic theory of turbulence for parallel propagation revisited: Low-to-intermediate frequency regime

A previous paper [P. H. Yoon, “Kinetic theory of turbulence for parallel propagation revisited: Formal results,” Phys. Plasmas 22, 082309 (2015)] revisited the second-order nonlinear kinetic theory for turbulence propagating in directions parallel/anti-parallel to the ambient magnetic field, in which the original work according to Yoon and Fang [Phys. Plasmas 15, 122312 (2008)] was refined, following the paper by Gaelzer et al. [Phys. Plasmas 22, 032310 (2015)]. The main finding involved the dimensional correction pertaining to discrete-particle effects in Yoon and Fang's theory. However, the final result was presented in terms of formal linear and nonlinear susceptibility response functions. In the present paper, the formal equations are explicitly written down for the case of low-to-intermediate frequency regime by making use of approximate forms for the response functions. The resulting equations are sufficiently concrete so that they can readily be solved by numerical means or analyzed by theoretical means. The derived set of equations describe nonlinear interactions of quasi-parallel modes whose frequency range covers the Alfvén wave range to ion-cyclotron mode, but is sufficiently lower than the electron cyclotron mode. The application of the present formalism may range from the nonlinear evolution of whistler anisotropy instability in the high-beta regime, and the nonlinear interaction of electrons with whistler-range turbulence.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

CONNECTING THE SUN AND THE SOLAR WIND: THE FIRST 2.5-DIMENSIONAL SELF-CONSISTENT MHD SIMULATION UNDER THE ALFVEN WAVE SCENARIO

The solar wind emanates from the hot and tenuous solar corona. Earlier studies using 1.5-dimensional simulations show that Alfven waves generated in the photosphere play an important role in coronal heating through the process of nonlinear mode conversion. In order to understand the physics of coronal heating and solar wind acceleration together, it is important to consider the regions from photosphere to interplanetary space as a single system. We performed 2.5-dimensional, self-consistent magnetohydrodynamic simulations, covering from the photosphere to the interplanetary space for the first time. We carefully set up the grid points with spherical coordinates to treat the Alfven waves in the atmosphere with huge density contrast and successfully simulate the solar wind streaming out from the hot solar corona as a result of the surface convective motion. The footpoint motion excites Alfven waves along an open magnetic flux tube, and these waves traveling upward in the non-uniform medium undergo wave reflection, nonlinear mode conversion from Alfven mode to slow mode, and turbulent cascade. These processes lead to the dissipation of Alfven waves and acceleration of the solar wind. It is found that the shock heating by the dissipation of the slow-mode wave plays a fundamental role in the coronal heating process, whereas the turbulent cascade and shock heating drive the solar wind.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2012

GALAXY MASS, METALLICITY, RADIUS, AND STAR FORMATION RATES

Working with 108,786 Sloan Digital Sky Survey (SDSS) low-redshift galaxies, we have examined the relation between galaxy mass, metallicity, radius, and star formation rates (SFRs) primarily in the central portions of galaxies. We subdivided the redshift range covered in our sample, 0.07 {<=} z {<=} 0.3, into three narrower redshift bins, and three sets of radial size. We show that for 72% of the galaxies the observed gas metallicities, Z{sub x} , are consistent with (1) a quantitative physical relation for star formation through episodic infall of gas of metallicity Z{sub i} = 0.125 Multiplication-Sign 10{sup -3} {+-} 1.25 Multiplication-Sign 10{sup -3}; (2) thorough mixing of infalling and native gas before onset of star formation; (3) an SFR proportional to the 3/2 power of the infalling mass rate, M-dot{sub i}; and (4) intermittent quiescent phases devoid of star formation during which the native gas in a galaxy exhibits a characteristic elevated gas metallicity, Z{sub 0}, dependent on galaxy mass, M{sub *}, and a characteristic ratio of stellar mass to native mass of gas, M{sub g} . Most if not all our star-forming galaxies with M{sub *} {<=} 2.0 Multiplication-Sign 10{sup 10} M{sub Sun }, and many with M{sub *} {>=} 2.0 Multiplication-Sign 10{sup 10} M{sub Sun} and large radii appear fed by infall. Smaller massive galaxies with high Z{sub x} and high SFRs show more complex behavior. A mean-field-theory toy model for the physics of infall accounts for the (SFR){proportional_to} M-dot{sub i}{sup 3/2} relation and permits us to estimate the mean densities and velocities of clumps of baryonic matter traversing the dark matter halos in which the SDSS galaxies may be embedded.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

Probing quantum processor performance with pyGSTi

PyGSTi is a Python software package for assessing and characterizing the performance of quantum computing processors. It can be used as a standalone application, or as a library, to perform a wide variety of quantum characterization, verification, and validation (QCVV) protocols on as-built quantum processors. In this work, we outline pyGSTi's structure, and what it can do, using multiple examples. We cover its main characterization protocols with end-to-end implementations. These include gate set tomography, randomized benchmarking on one or many qubits, and several specialized techniques. We also discuss and demonstrate how power users can customize pyGSTi and leverage its components to create specialized QCVV protocols and solve user-specific problems.

97 MATHEMATICS AND COMPUTING↗
DOE OSTI2021

Computational Fluid Dynamics (CFD) Simulations of Taylor Bubbles in Vertical and Inclined Pipes with Upward and Downward Liquid Flow

Summary Two-phase flow is a common occurrence in pipes of oil and gas developments. Current predictive tools are based on the mechanistic two-fluid model, which requires the use of closure relations to predict integral flow parameters such as liquid holdup (or void fraction) and pressure gradient. However, these closure relations carry the highest uncertainties in the model. In particular, significant discrepancies have been found between experimental data and closure relations for the Taylor bubble velocity in slug flow, which has been determined to strongly affect the mechanistic model predictions (Lizarraga-García 2016). In this work, we study the behavior of Taylor bubbles in vertical and inclined pipes with upward and downward flow using a validated 3D computational fluid dynamics (CFD) approach with level set method implemented in a commercial code. A total of 56 cases are simulated, covering a wide range of fluid properties, pipe diameters, and inclination angles: Eo ∈ [10, 700]; Mo ∈ [1×10–6, 5×103]; ReSL ∈ [–40, 10]; θ ∈ [5°, 90°]. For bubbles in vertical upward flows, the simulated distribution parameter, C0, is successfully compared with an existing model. However, the C0 values of downward and inclined slug flows where the bubble becomes asymmetric are shown to be significantly different from their respective vertical upward flow values, and no current model exists for the fluids simulated here. The main contributions of this work are (1) the relatively large 3D numerical database generated for this type of flow, (2) the study of the asymmetric nature of inclined and some vertical downward slug flows, and (3) the analysis of its impact on the distribution parameter, C0.

Engineering↗
DOE OSTI2014

Building America Indoor Temperature and Humidity Measurement Protocol

When modeling homes using simulation tools, the heating and cooling set points can have a significant impact on home energy use. Every 4 years the Energy Information Administration (EIA) Residential Energy Consumption Survey (RECS) asks homeowners about their heating and cooling set points. Unfortunately, no temperature data is measured, and most of the time, the homeowner may be guessing at this number. Even one degree Fahrenheit difference in heating set point can make a 5% difference in heating energy use! So, the survey-based RECS data cannot be used as the definitive reference for the set point for the 'average occupant' in simulations. The purpose of this document is to develop a protocol for collecting consistent data for heating/cooling set points and relative humidity so that an average set point can be determined for asset energy models in residential buildings. This document covers the decision making process for researchers to determine how many sensors should be placed in each home, where to put those sensors, and what kind of asset data should be taken while they are in the home. The authors attempted to design the protocols to maximize the value of this study and minimize the resources required to achieve that value.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2014

The Building America Indoor Temperature and Humidity Measurement Protocol

When modeling homes using simulation tools, the heating and cooling set points can have a significant impact on home energy use. Every four years, the Energy Information Administration (EIA) Residential Energy Consumption Survey (RECS) asks homeowners about their heating and cooling set points. Unfortunately, no temperature data is measured, and most of the time, the homeowner may be guessing at this number. Even one degree Fahrenheit difference in heating set point can make a 5% difference in heating energy use! So, the survey-based RECS data cannot be used as the definitive reference for the set point for the "average occupant" in simulations. The purpose of this document is to develop a protocol for collecting consistent data for heating/cooling set points and relative humidity so that an average set point can be determined for asset energy models in residential buildings. This document covers the decision making process for researchers to determine how many sensors should be placed in each home, where to put those sensors, and what kind of asset data should be taken while they are in the home. The authors attempted to design the protocols to maximize the value of this study and minimize the resources required to achieve that value.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2021

A Broad Grid of 2D Kilonova Emission Models

Depending upon the properties of their compact remnants and the physics included in the models, simulations of neutron star mergers can produce a broad range of ejecta properties. The characteristics of this ejecta, in turn, define the kilonova emission. To explore the effect of ejecta properties, we present a grid of 2-component 2D axisymmetric kilonova simulations that vary mass, velocity, morphology, and composition. The masses and velocities of each component vary, respectively, from 0.001 to 0.1 M ⊙ and 0.05 to 0.3c, covering much of the range of results from the neutron star merger literature. The set of 900 models is constrained to have a toroidal low electron fraction (Y e ) ejecta with a robust r-process composition and either a spherical or lobed high-Y e ejecta with two possible compositions. We simulate these models with the Monte Carlo radiative transfer code SuperNu using a full suite of lanthanide and 4th row element opacities. We examine the trends of these models with parameter variation, show how it can be used with statistical tools, and compare the model light curves and spectra to those of AT2017gfo, the electromagnetic counterpart of GW170817.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Turbulence in Magnetized Pair Plasmas

Alfvénic-type turbulence in strongly magnetized, low-beta pair plasmas is investigated. A coupled set of equations for the evolution of the magnetic and flow potentials are derived, covering both fluid and kinetic scales. In the fluid (magnetohydrodynamic) range those equations are the same as for electron–ion plasmas, so turbulence at those scales is expected to be of the Alfvénic nature, exhibiting critical balance, dynamic alignment, and transition to a tearing-mediated regime at small scales. The critical scale at which a transition to a tearing-mediated range occurs is derived, and the spectral slope in that range is predicted to be ${k}_{\perp }^{-8/3}$ (or ${k}_{\perp }^{-3}$, depending on details of the reconnecting configuration assumed). At scales below the electron (and positron) skin depth, it is argued that turbulence is dictated by a cascade of the inertial Alfvén wave, which we show to result in the magnetic energy spectrum $\propto {k}_{\perp }^{-11/3}$.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

Data generated during the 2018 LAPSE-RATE campaign: an introduction and overview

Unmanned aircraft systems (UASs) offer innovative capabilities for providing new perspectives on the atmosphere, and therefore atmospheric scientists are rapidly expanding their use, particularly for studying the planetary boundary layer. In support of this expansion, from 14 to 20 July 2018 the International Society for Atmospheric Research using Remotely piloted Aircraft (ISARRA) hosted a community flight week, dubbed the Lower Atmospheric Profiling Studies at Elevation – a Remotely-piloted Aircraft Team Experiment (LAPSE-RATE; de Boer et al., 2020a). This field campaign spanned a 1-week deployment to Colorado's San Luis Valley, involving over 100 students, scientists, engineers, pilots, and outreach coordinators. These groups conducted intensive field operations using unmanned aircraft and ground-based assets to develop comprehensive datasets spanning a variety of scientific objectives, including a total of nearly 1300 research flights totaling over 250 flight hours. This article introduces this campaign and lays the groundwork for a special issue on the LAPSE-RATE project. The remainder of the special issue provides detailed overviews of the datasets collected and the platforms used to collect them. All of the datasets covered by this special issue have been uploaded to a LAPSE-RATE community set up at the Zenodo data archive (https://zenodo.org/communities/lapse-rate/, last access: 3 December 2020).

47 OTHER INSTRUMENTATION↗
DOE OSTI2018

Turbulence in Magnetized Pair Plasmas

Alfvenic-type turbulence in strongly magnetized, low-beta pair plasmas is investigated. A coupled set of equations for the evolution of the magnetic and flow potentials are derived, covering both fluid and kinetic scales. In the fluid (MHD) range those equations are the same as for electron-ion plasmas, so turbulence at those scales is expected to be of the Alfvenic nature, exhibiting critical balance, dynamic alignment, and transition to a tearing mediated regime at small scales. The critical scale at which a transition to a tearing-mediated range occurs is derived, and the spectral slope in that range is predicted to be $k_\perp^{-8/3}$ (or $k_\perp^{-3}, depending on details of the reconnecting configuration assumed). At scales below the electron (and positron) skin depth, it is argued that turbulence is dictated by a cascade of the inertial Alfven wave, which we show to result in the magnetic energy spectrum $propto k_\perp^{-11/3}$.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS1972

Radiation Protection Handbook

A handbook which sets forth the Kennedy Space Center radiation protection policy is presented. The book also covers administrative direction and guidance on organizational and procedural requirements of the program. Only ionizing radiation is covered.

Source record↗
NASA NTRS1974

Aerodynamic performance of 0.5 meter-diameter, 337 meter-per-second tip speed, 1.5 pressure-ratio, single-stage fan designed for low noise aircraft engines

Overall and blade-element aerodynamic performance of a 0.271-scale model of QF-1 are presented, examined, and then compared and evaluated with that from similar low noise fan stage designs. The tests cover a wide range of speeds and weight flows along with variations in stator setting angle and stator axial spacing from the rotor. At design speed with stator at design setting angle and a fixed distance between stage measuring stations, there were no significant effects of increasing the axial spacing between rotor stator from 1.0 to 3.5 rotor chords on stage overall pressure ratio, efficiency or stall margin.

Gelder, T. F.↗
NASA NTRS1976

Performance, emissions, and physical characteristics of a rotating combustion aircraft engine

The RC2-75, a liquid cooled two chamber rotary combustion engine (Wankel type), designed for aircraft use, was tested and representative baseline (212 KW, 285 BHP) performance and emissions characteristics established. The testing included running fuel/air mixture control curves and varied ignition timing to permit selection of desirable and practical settings for running wide open throttle curves, propeller load curves, variable manifold pressure curves covering cruise conditions, and EPA cycle operating points. Performance and emissions data were recorded for all of the points run. In addition to the test data, information required to characterize the engine and evaluate its performance in aircraft use is provided over a range from one half to twice its present power. The exhaust emissions results are compared to the 1980 EPA requirements. Standard day take-off brake specific fuel consumption is 356 g/KW-HR (.585 lb/BHP-HR) for the configuration tested.

Berkowitz, M.↗
NASA NTRS1977

Surface finishing

A surface of an article adapted for relative motion with a fluid environment is finished by coating the surface with a fluid adhesive. The adhesive is covered with a sheet of flexible film material under tension, and the adhesive is set while maintaining tension on the film material.

Kinzler, J. A.↗
NASA NTRS1978

Pioneer Venus 1 launch set for May 20

The launch and cruise phases of both the Pioneer Venus Orbiter and the Multiprobe spacecraft are covered. Much of the material is also pertinent to the Venus encounter.

Source record↗