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At least 739 records · Page 41

All sources NASA NTRS DOE OSTI

DOE OSTI2024

Evaluation of Aliphatic Alcohols for CO 2 Capture Using the Characteristic Carbonate Frequency

Control over CO 2 capture and utilization are important scientific and technological challenges. Although a variety of amine absorbents are used for capture, releasing the captured CO 2 is often difficult and limits their recyclability. Therefore, it is crucial to control the strength of the CO 2 bond with the absorbent. Furthermore, it is desirable to use a method that can conveniently report the strength of this bond. This motivates exploring adducts of CO 2 with alcohols in the presence of a base, using vibrational spectroscopy to report on the bond strength. Although reactions of alcohols with CO 2 to form alkyl carbonates are known, a systematic study of these adducts has not been conducted. Here we show formation of alkyl carbonates by a series of alcohols spanning the pK a range 9.5 to 16.8. We show experimental and computational results for the frequency of the characteristic asymmetric stretch of the carbonate and demonstrate that it correlates inversely with the pK a of the alcohol. Based on computations of the bond lengths and previous work, we propose that this frequency also correlates inversely with the adduct strength. As a result, this work extends the scope of CO 2 capture reagents and inspires further research in tuning alcohols as reversible absorbents.

Alcohols↗

DOE OSTI2017

Chiral Majorana fermion modes in a quantum anomalous Hall insulator–superconductor structure

Majorana fermion is a hypothetical particle that is its own antiparticle. We report transport measurements that suggest the existence of one-dimensional chiral Majorana fermion modes in the hybrid system of a quantum anomalous Hall insulator thin film coupled with a superconductor. As the external magnetic field is swept, half-integer quantized conductance plateaus are observed at the locations of magnetization reversals, giving a distinct signature of the Majorana fermion modes. This transport signature is reproducible over many magnetic field sweeps and appears at different temperatures. This finding may open up an avenue to control Majorana fermions for implementing robust topological quantum computing.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2013

A Systems Biology Platform for Characterizing Regulatory and Metabolic Pathways that Influence and Control Microbial Hydrogen Production

In this project, we created a novel systems biology technology platform and resources that can be used to reverse engineer and analyze gene regulatory networks and metabolic pathways that influence and control microbial hydrogen production. We constructed genome-scale transcriptional regulatory and metabolic models using automated model reconstruction methods, and subsequently integrated the regulatory and metabolic models for computational analysis. We devised novel algorithms for inferring putative regulatory architectures of metabolic pathways based on their topology, and for integrating gene expression information in flux balance analysis (FBA) models towards computing dynamical changes in metabolic objectives. From a metabolic engineering perspective, we improved and applied a method for predicting optimal environmental conditions and genetic modifications towards maximal productions of multiple desired metabolic outputs. We also developed and tested an improved flux balance approach for predicting the response of metabolic networks to genetic perturbations, proving that errors in model predictions are approaching the limit of experimental uncertainty. We also used the metabolic and regulatory models to identify relevant metabolic processes and pathways involved in hydrogen production. Below we provide a summary and details of our achievements.

Collins, James J.↗

NASA NTRS1972

Large-scale solar magnetic fields and H-alpha patterns

Coronal and interplanetary magnetic fields computed from measurements of large-scale photospheric magnetic fields suffer from interruptions in day-to-day observations and the limitation of using only measurements made near the solar central meridian. Procedures were devised for inferring the lines of polarity reversal from H-alpha solar patrol photographs that map the same large-scale features found on Mt. Wilson magnetograms. These features may be monitored without interruption by combining observations from the global network of observatories associated with NOAA's Space Environment Services Center. The patterns of inferred magnetic fields may be followed accurately as far as 60 deg from central meridian. Such patterns will be used to improve predictions of coronal features during the next solar eclipse.

Mcintosh, P. S.↗

NASA NTRS1980

Inelastic behavior of structural components

A more accurate procedure was developed for the determination of the inelastic behavior of structural components. The actual stress-strain curve for the mathematical of the structure was utilized to generate the force-deformation relationships for the structural elements, rather than using simplified models such as elastic-plastic, bilinear and trilinear approximations. relationships were generated for beam elements with various types of cross sections. In the generational of these curves, stress or load reversals, kinematic hardening and hysteretic behavior were taken into account. Intersections between loading and unloading branches were determined through an iterative process. Using the inelastic properties obtained, the plastic static response of some simple structural systems composed of beam elements was computed. Results were compared with known solutions, indicating a considerable improvement over response predictions obtained by means of simplified approximations used in previous investigations.

Hussain, N.↗

NASA NTRS1988

Climatology of the stratospheric polar vortex and planetary wave breaking

The distribution of Ertel's potential vorticity (PV) on the 850 K isentropic surface is used to establish a climatology for the transient evolution of the planetary scale circulation in the Northern Hemisphere winter midstratosphere. PV distributions are computed from gridded NMC daily temperature and height maps for the 10 and 30 mb levels, and show that a very good approximation for 850 K PV can be derived from 10 mb heights and temperatures alone. It is assumed that reversals of the latitudinal gradient of PV, localized in longitude and latitude may be regarded as signatures of planetary wave breaking. Wave breaking identified by such signatures tends to occur mainly in the vicinity of the Aleutian anticyclone, with a secondary maximum over Europe. The area of the polar vortex, defined as the area enclosed by PV contours greater than a certain critical value, is strongly influenced by wave breaking. Erosion of the polar vortex due to transport and mixing of PV leads to a preconditioned state, when defined in terms of vortex area, that always occurs prior to major stratospheric warmings. During winters with little PV transport or mixing, the vortex area evolves rather uniformly in response to radiative forcing. During winters with major sudden warmings, the wave breaking signature as defined here first appears at low values of PV, then rapidly moves toward higher values as the vortex area is reduced and the 'surf-zone' structure becomes well defined.

Baldwin, Mark P.↗

NASA NTRS1992

Aeroservoelasticity in HiSAIR

The High Speed Airframe Integration Research project is a multidisciplinary effort to bridge disciplinary boundaries in the analysis and design of aircraft. Aeroservoelasticity provides calculations of various critical speeds (such as flutter, divergence, and control reversal), of hump mode dampings, and of the effects of flexibility on vehicle stability and control derivatives. For design iterations, sensitivity derivatives of these characteristics with respect to structural design variables are also calculated. For executing this function, a set of computer programs was developed or adapted to perform routine calculations of basic aeroelastic characteristics. This set of programs, named the Aeroelastic Vehicle Analysis system, has also become a useful tool within the Aeroservoelasticity Branch of NASA's Langley Research Center.

Zeiler, Thomas A.↗

NASA NTRS1996

A Conservation Strategy for the Florida Scrub-Jay on John F. Kennedy Space Center/Merritt Island National Wildlife Refuge: An Initial Scientific Basis for Recovery

The Florida Scrub-Jay (Aphelocoma coerulescens) is an indicator of ecosystem integrity of Florida scrub, an endangered ecosystem that requires frequent fire. One of the largest populations of this federally threatened species occurs on John F. Kennedy Space Center/Merritt Island National Wildlife Refuge. Population trends were predicted using population modeling and field data on reproduction and survival of Florida Scrub-Jays collected from 1988 - 1995. Analyses of historical photography indicated that habitat suitability has been declining for 30 years. Field data and computer simulations suggested that the population declined by at least 40% and will decline by another 40% in 1 0 years, if habitat management is not greatly intensified. Data and computer simulations suggest that habitat suitability cannot deviate greatly from optimal for the jay population to persist. Landscape trajectories of vegetation structure, responsible for declining habitat suitability, are associated with the disruption of natural fire regimes. Prescribed fire alone can not reverse the trajectories. A recovery strategy was developed, based on studies of Florida Scrub-Jays and scrub vegetation. A reserve design was formulated based on conservation science principles for scrub ecosystems. The strategy emphasizes frequent fire to restore habitat, but includes mechanical tree cutting for severely degraded areas. Pine thinning across large areas can produce rapid increases in habitat quality. Site-specific strategies will need to be developed, monitored, and modified to achieve conditions suitable for population persistence.

Breininger, D. R.↗

NASA NTRS1998

Conversion from Engineering Units to Telemetry Counts on Dryden Flight Simulators

Dryden real-time flight simulators encompass the simulation of pulse code modulation (PCM) telemetry signals. This paper presents a new method whereby the calibration polynomial (from first to sixth order), representing the conversion from counts to engineering units (EU), is numerically inverted in real time. The result is less than one-count error for valid EU inputs. The Newton-Raphson method is used to numerically invert the polynomial. A reverse linear interpolation between the EU limits is used to obtain an initial value for the desired telemetry count. The method presented here is not new. What is new is how classical numerical techniques are optimized to take advantage of modem computer power to perform the desired calculations in real time. This technique makes the method simple to understand and implement. There are no interpolation tables to store in memory as in traditional methods. The NASA F-15 simulation converts and transmits over 1000 parameters at 80 times/sec. This paper presents algorithm development, FORTRAN code, and performance results.

Fantini, Jay A.↗

NASA NTRS2002

A Two-Dimensional Linear Bicharacteristic FDTD Method

The linear bicharacteristic scheme (LBS) was originally developed to improve unsteady solutions in computational acoustics and aeroacoustics. The LBS has previously been extended to treat lossy materials for one-dimensional problems. It is a classical leapfrog algorithm, but is combined with upwind bias in the spatial derivatives. This approach preserves the time-reversibility of the leapfrog algorithm, which results in no dissipation, and it permits more flexibility by the ability to adopt a characteristic based method. The use of characteristic variables allows the LBS to include the Perfectly Matched Layer boundary condition with no added storage or complexity. The LBS offers a central storage approach with lower dispersion than the Yee algorithm, plus it generalizes much easier to nonuniform grids. It has previously been applied to two and three-dimensional free-space electromagnetic propagation and scattering problems. This paper extends the LBS to the two-dimensional case. Results are presented for point source radiation problems, and the FDTD algorithm is chosen as a convenient reference for comparison.

Beggs, John H.↗

NASA NTRS2004

NASA Tech Briefs, June 2004

Topics covered include: COTS MEMS Flow-Measurement Probes; Measurement of an Evaporating Drop on a Reflective Substrate; Airplane Ice Detector Based on a Microwave Transmission Line; Microwave/Sonic Apparatus Measures Flow and Density in Pipe; Reducing Errors by Use of Redundancy in Gravity Measurements; Membrane-Based Water Evaporator for a Space Suit; Compact Microscope Imaging System with Intelligent Controls; Chirped-Superlattice, Blocked-Intersubband QWIP; Charge-Dissipative Electrical Cables; Deep-Sea Video Cameras Without Pressure Housings; RFID and Memory Devices Fabricated Integrally on Substrates; Analyzing Dynamics of Cooperating Spacecraft; Spacecraft Attitude Maneuver Planning Using Genetic Algorithms; Forensic Analysis of Compromised Computers; Document Concurrence System; Managing an Archive of Images; MPT Prediction of Aircraft-Engine Fan Noise; Improving Control of Two Motor Controllers; Electro-deionization Using Micro-separated Bipolar Membranes; Safer Electrolytes for Lithium-Ion Cells; Rotating Reverse-Osmosis for Water Purification; Making Precise Resonators for Mesoscale Vibratory Gyroscopes; Robotic End Effectors for Hard-Rock Climbing; Improved Nutation Damper for a Spin-Stabilized Spacecraft; Exhaust Nozzle for a Multitube Detonative Combustion Engine; Arc-Second Pointer for Balloon-Borne Astronomical Instrument; Compact, Automated Centrifugal Slide-Staining System; Two-Armed, Mobile, Sensate Research Robot; Compensating for Effects of Humidity on Electronic Noses; Brush/Fin Thermal Interfaces; Multispectral Scanner for Monitoring Plants; Coding for Communication Channels with Dead-Time Constraints; System for Better Spacing of Airplanes En Route; Algorithm for Training a Recurrent Multilayer Perceptron; Orbiter Interface Unit and Early Communication System; White-Light Nulling Interferometers for Detecting Planets; and Development of Methodology for Programming Autonomous Agents.

Source record↗

NASA NTRS1997

Reduced Navier Stokes Relaxation Procedures for Internal Flows

In spite of significant advancement in the field of high speed computing, flow calculations involving complex geometries and/or flow behavior still require large amounts of CPU time and memory. In order to predict such flows without sacrificing grid convergence and accuracy, adaptive gridding techniques that provide optimal resolution are highly desirable. The present work combines multigrid techniques and domain decomposition concepts to provide local, solution adaptive, grid refinement. Several viscous compressible and incompressible, two and three-dimensional, flows with strong inviscid interaction and/or axial flow reversal, are considered with a segmented multigrid domain decomposition (SMGDD) procedure for which uniform meshes result in each domain. A pressure-based form of flux-vector splitting is applied to the Navier-Stokes equations, which are represented by an implicit lowest-order reduced Navier-Stokes (RNS) system and a purely diffusive, higher-order, deferred-corrector. A trapezoidal or box-like form of discretization insures that all mass conservation properties are satisfied at interfacial and outflow boundaries, even for this primitive-variable non-staggered grid computation. The SMGDD technique presented herein has previously been applied for incompressible two dimensional flows. The present work offers improvement in the gridding strategy, by allowing for disjoint subdomains that provide optimal resolution of disparate flow features. It also extends the SMGDD technique to three dimensional compressible flows. Laminar and turbulent flow in a backward facing step channel is considered; although the procedure is applicable to more severe geometries. The standard K-epsilon model is applied for turbulence closure. For Re greater than 400, differences between two-dimensional theory and experiment are resolved through a three dimensional simulation, which confirms the experimentally observed three dimensionality of the recirculation patterns on the upper and lower surfaces.

Rubin, Stanley G.↗

DOE OSTI2018

Multielectron Redox Chemistry of Transition Metal Complexes Supported by a Non-Innocent N 3 P 2 Ligand: Synthesis, Characterization, and Catalytic Properties

A new redox-active, diarylamido-based ligand (L N3P2 ) capable of κ 5 -N,N,N,P,P chelation has been used to prepare a series of complexes with the general formula [M II (L N3P2 )]X, where M = Fe (1; X = OTf), Co (2; X = ClO 4 ), or Ni (3; X = ClO 4 ). The diarylamido core of monoanionic L N3P2 is derived from bis(2-amino-4-methylphenyl)amine, which undergoes condensation with two equivalents of 2-(diphenylphosphanyl)benzaldehyde to provide chelating arms with both arylphosphine and imine donors. X-ray structural, magnetic, and spectroscopic studies indicate that the N 3 P 2 coordination environment generally promotes low-spin configurations. Three quasi-reversible redox couples between +1.0 and –1.5 V (vs. Fc + /Fc) were observed in voltammetric studies of each complex, corresponding to M II /M III oxidation, L N3P2 -based oxidation, and MII/MI reduction (in order of highest to lowest potential). Spectroscopic and computational analyses of 3 ox – generated via chemical one-electron oxidation of 3 – revealed that a stable diarylaminyl radical (L N3P2· ) is formed upon oxidation. The ability of the Co II complex (2) to function as an electrocatalyst for H 2 generation was evaluated in the presence of weak acids. Moderate activity was observed using 4-tert-butylphenol as the proton source at potentials below –2.0 V. The insights gained here will assist in the future design of pentadentate mixed N/P-based chelates for catalytic processes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2023

Reversible transformations between the non-porous phases of a flexible coordination network enabled by transient porosity

Abstract Flexible metal–organic materials that exhibit stimulus-responsive switching between closed (non-porous) and open (porous) structures induced by gas molecules are of potential utility in gas storage and separation. Such behaviour is currently limited to a few dozen physisorbents that typically switch through a breathing mechanism requiring structural contortions. Here we show a clathrate (non-porous) coordination network that undergoes gas-induced switching between multiple non-porous phases through transient porosity, which involves the diffusion of guests between discrete voids through intra-network distortions. This material is synthesized as a clathrate phase with solvent-filled cavities; evacuation affords a single-crystal to single-crystal transformation to a phase with smaller cavities. At 298 K, carbon dioxide, acetylene, ethylene and ethane induce reversible switching between guest-free and gas-loaded clathrate phases. For carbon dioxide and acetylene at cryogenic temperatures, phases showing progressively higher loadings were observed and characterized using in situ X-ray diffraction, and the mechanism of diffusion was computationally elucidated.

Chemistry↗

DOE OSTI2020

Notes on Eulerian Magnetohydrodynamics

A brief description of the MHD equations used in the eulerian AMR code BABBO is presented. The description of the MHD equations has been presented many times in the literature so only a very brief description is given in this report. Of particular importance is the description of the calculation of the plasma load impedance and inductance, which is much less frequently described in the literature and is presented in section 6. In addition, along with an accurate calculation of the plasma load impedance and induction, the circuit calculation used to introduce the external current drive is of particular importance and is presented in section 7. In section 8 a procedure is presented to calculate the current drive of a Marx bank by reverse engineering a machine voltage source, which can then be used to drive varying plasma loads.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2020

Energy-Efficient Self-Organization and Swarm Behavior in Active Matter

Living systems have the unique ability to form hierarchical assemblies, in which individual constituents can perform tasks cooperatively and emergently. Harnessing such properties is a long-standing challenge for the rational design of dynamic materials, that can respond to their environment, communicate with one another, and undergo a rapid, reversible, assembly through the transduction of energy. Recent developments in the design of smart and active colloidal building blocks have led to tremendous breakthroughs, with, for instance, the onset of synthetic photoactivated active assemblies. In this project, we develop a combined experimental, computational, theoretical and Machine Learning framework to shed light on the physical underpinnings of such assembly processes and program the assembly of smart active materials.

36 MATERIALS SCIENCE↗

NASA NTRS1991

Experimental and analytical studies of flow through a ventral and axial exhaust nozzle system for STOVL aircraft

Flow through a combined ventral and axial exhaust nozzle system was studied experimentally and analytically. The work is part of an ongoing propulsion technology effort at NASA Lewis Research Center for short takeoff, vertical landing (STOVL) aircraft. The experimental investigation was done on the NASA Lewis Powered Lift Facility. The experiment consisted of performance testing over a range of tailpipe pressure ratios from 1 to 3.2 and flow visualization. The analytical investigation consisted of modeling the same configuration and solving for the flow using the PARC3D computational fluid dynamics program. The comparison of experimental and analytical results was very good. The ventral nozzle performance coefficients obtained from both the experimental and analytical studies agreed within 1.2 percent. The net horizontal thrust of the nozzle system contained a significant reverse thrust component created by the flow overturning in the ventral duct. This component resulted in a low net horizontal thrust coefficient. The experimental and analytical studies showed very good agreement in the internal flow patterns.

Esker, Barbara S.↗

NASA NTRS1991

Experimental and analytical studies of flow through a ventral and axial exhaust nozzle system for STOVL aircraft

Esker, Barbara S.↗