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All sourcesNASA NTRSDOE OSTI
NASA NTRS1998

Doping Scheme of Semiconducting Atomic Chains

Atomic chains, precise structures of atomic scale created on an atomically regulated substrate surface, are candidates for future electronics. A doping scheme for intrinsic semiconducting Mg chains is considered. In order to suppress the unwanted Anderson localization and minimize the deformation of the original band shape, atomic modulation doping is considered, which is to place dopant atoms beside the chain periodically. Group I atoms are donors, and group VI or VII atoms are acceptors. As long as the lattice constant is long so that the s-p band crossing has not occurred, whether dopant atoms behave as donors or acceptors is closely related to the energy level alignment of isolated atomic levels. Band structures are calculated for Br-doped (p-type) and Cs-doped (n-type) Mg chains using the tight-binding theory with universal parameters, and it is shown that the band deformation is minimized and only the Fermi energy position is modified.

Toshishige, Yamada↗
NASA NTRS1972

Fracture Behavior in Nylon 6 Fibers

Electron paramagnetic resonance (EPR) techniques are used to determine the number of free radicals produced during deformation leading to fracture of nylon 6 fibers. A reaction rate molecular model is proposed to explain some of the deformation and bond rupture behavior leading to fracture. High-strength polymer fibers are assumed to consist of a sandwich structure of disordered and ordered regions along the fiber axis. In the disordered or critical flaw regions, tie chains connecting the ordered or crystalline block regions are assumed to have a statistical distribution in length. These chains are, therefore, subjected to different stresses. The effective length distribution was determined by EPR. The probability of bond rupture was assumed to be controlled by reaction-rate theory with a stress-aided activation energy and behavior of various loadings determined by numerical techniques. The model is successfully correlated with experimental stress, strain, and bond rupture results for creep, constant rate loadings, cyclic stress, stress relaxation and step strain tests at room temperature.

Lloyd, B. A.↗
NASA NTRS1976

Jupiter: Studies of the interior, atmosphere, magnetosphere and satellites; Proceedings of the Colloquium, Tucson, Ariz., May 19-21, 1975

This volume is a comprehensive technical text covering all scientific aspects of Jupiter's interior, atmosphere, magnetosphere, and satellites. The chapters deal with such general subjects as the origin and interior structure of Jupiter, the planet's atmosphere and ionosphere, as well as its magnetosphere, radiation belts, and satellites. Specific topics include a review of theories on the origin and structure of Jupiter and its satellites, interior models of Jupiter, the planet's gravity field, its thermal and atmospheric structure, model ionospheres, chemistry and spectroscopy of the atmosphere, the IR spectrum of the planet, and the meteorology of the atmosphere. Other chapters discuss radio observations of Jupiter, the dynamics of the Jovian magnetosphere, structural and thermal models of the icy Galilean satellites and Io's atmosphere and optical emissions. Results are evaluated for the IR radiometer experiment on Pioneers 10 and 11, radio occultation measurements from the Pioneer probes, Pioneer 10 UV photometric observations of the planet and its satellites, Pioneer 10 and 11 imaging polarimetry, the plasma analyzer experiment on the two probes, and observations of energetic Jovian electrons and protons. Individual items are announced in this issue.

Gehrels, T.↗
NASA NTRS1991

Simulator evaluation of system identification with on-line control law update for the controls and astrophysics experiment in space

A procedure for optimizing the performance of large flexible spacecraft that require active vibration suppression to achieve required performance is presented. The procedure is to conduct on-orbit testing and system identification followed by a control system design. It is applied via simulation to a spacecraft configuration currently being considered for flight test by NASA - the Controls, Astrophysics, and Structures Experiment in Space (CASES). The system simulator is based on a NASTRAN finite element structural model. A finite number of modes is used to represent the structural dynamics. The system simulator also includes models of the electronics, actuators, sensors, the digital controller, and the internal and external disturbances. Nonlinearities caused by quantization are included in the study to examine tolerance of the procedure to modelling errors. Disturbance and sensor noise is modelled as a Gaussian process. For system identification, the system is excited using sinusoidal inputs at the resonant frequencies of the structure using each actuator. Mode shapes, frequencies, and damping ratios are identified from the unforced response sensor data after each excitation. Then, the excitation data is used to identify the actuator influence coefficients. The results of the individual parameter identification analyses are assembled into an aggregate system model. The control design is accomplished based only on the identified model using multi-input/output linear quadratic Gaussian theory. Its performance is evaluated based on time-to-damp as compared with the uncontrolled structure.

Montgomery, Raymond C.↗
NASA NTRS2003

Modeling of Carbon Nanotube Schottky Barrier Reduction for Holes in Air

A model is proposed for the recently observed lower Schottky barrier for holes in air than in vacuum at a metallic electrode - semiconducting carbon nanotube (CNT) junction. In air, the CNT is oxidized. The oxygen molecules on the CNT surface will attract negative charges and will be negatively charged. The negative charges on the solid surface generally enhance the surface dipole and provide stronger electron confinement within the solid. Thus the CNT work function will increase in air. Then the Schottky barrier for holes will have to increase in air according to the standard band-alignment theory, but this is against the experiment. In order to overcome this difficulty, we propose a new Schottky barrier model, assuming that there is a transition region between the electrode and the CNT, where an appreciable potential can drop. We assume that electrodes are placed at the side of the CNT and the contact is formed via the van der Waals interaction. Since the electrode surface is not atomically flat in practical situations, the contact will not be intimate and there will be a transition region before the usual metallic bulk structure starts. In this view, the Schottky barrier is determined not only by the work function difference of the electrodes and the CNT, but also by the potential drop in the transition region. The oxidation increases the potential drop and leads to a lower Schottky barrier for holes. This relation will be demonstrated in a graphical manner by expressing the potential drop as a function of CNT band bending. The potential drop is comparable to the CNT band gap when, e.g., the transition region is about a few Angstroms thick, the oxygen molecule coverage is about 10 %, and an oxygen molecule is charged by about 0.01-0.1 of the unit charge (1-10 % of molecules are charged). The proposed mechanism prevails for both p - and n-CNTs. The model consistently explains the CNT oxidation experiments reported so far.

Yamada, Toshishige↗
NASA NTRS1975

Denouement of Jovian radiation belt theory

Predictions of theoretical models of Jupiter's radiation belts are compared with Pioneer 10 measurements. A brief quasi-historical review is given of the evolution of the basic theoretical ideas with emphasis on the three physical processes that were believed to be dominant in the Jovian electron fluxes: radial-diffusion transport, limitation of particle fluxes by plasma wave turbulence, and particle losses from collisional sweep-up by the Galilean satellites. Pioneer 10 data on the inner zone are discussed which yield the clearest evidence for radial diffusion being the dominant transport process, the synchrotron flux density is estimated using Pioneer 10 measurements, and the observed outer-zone electron fluxes are favorably compared with the qualitative and quantitative predictions of the whistler-mode stable-trapping model. The outer-zone electron-precipitation flux is estimated, and it is suggested that precipitation could affect the structure of the Jovian ionosphere. Satellite sweep-up is shown to be less severe than had been anticipated.

Coroniti, F. V.↗
NASA NTRS1995

Reionization and the cosmic microwave background in an open universe

If the universe was reionized at high reshift (z greater than or approximately equal to 30) or never recombined, then photon-electron scattering can erase fluctuations in the cosmic microwave background at scales less than or approximately equal to 1 deg. Peculiar motion at the surface of last scattering will then have given rise to new anisotropy at the 1 min level through the Vishniac effect. Here the observed fluctuations in galaxy counts are extrapolated to high redshifts using linear theory, and the expected anisotropy is computed. The predicted level of anisotropies is a function of Omega(sub 0) and the ratio of the density in ionized baryons to the critical density and is shown to depend strongly on the large- and small-scale power. It is not possible to make general statements about the viability of all reionized models based on current observations, but it is possible to rule out specific models for structure formation, particularly those with high baryonic content or small-scale power. The induced fluctuations are shown to scale with cosmological parameters and optical depth.

Persi, Fred M.↗
NASA NTRSDate not supplied

Towards Accurate Predictions of Martensitic Transition Temperatures for Shape Memory Alloys from Ab Initio Simulations

Experimentally, NiTi undergoes a single martensitic phase transition around 341 K from the lowtemperature (T) monoclinic B19’ phase (P21/m) to the high-temperature cubic B2 phase (Pm3m). Theoretically, an orthorhombic B33 (Cmcm) has also been proposed as the T=0 ground state structure, although this phase has never been observed. Accurate predictions of martensitic transition temperatures (MTT) have remained elusive in part due to several well-known theoretical complexities of these systems including low temperature instabilities of the B2 phase. Recently, we proposed a rigorous thermodynamic integration approach based on ab initio simulations to resolve many of these difficulties [1,2]. However, an unsatisfying overprediction of the MTT relative to experiment (by ~100 K) means a fully quantitative theory is still lacking. In this work, we report several new developments to our method that bring first principles theory and experiment much closer into agreement. Our calculations indicate that phonon free energies at low temperature stabilizes B19’ over B33, rationalizing B19’ as the ground state down to T=0. We also find that accurate computations of the electronic free energy, i.e. the change in energy and the appearance of electronic configurational entropy due to finite temperature, is crucial to obtain accurate MTT. Incorporating these corrections results in an MTT prediction of 365 K for binary NiTi, which is in very close agreement with experiment. Our theoretical approach is expected to be a broadly applicable and predictive theory for MTT of SMAs.

Zhigang Wu↗
NASA NTRS2014

Validation of Spherically Symmetric Inversion by Use of a Tomographically Reconstructed Three-Dimensional Electron Density of the Solar Corona

Determining the coronal electron density by the inversion of white-light polarized brightness (pB) measurements by coronagraphs is a classic problem in solar physics. An inversion technique based on the spherically symmetric geometry (spherically symmetric inversion, SSI) was developed in the 1950s and has been widely applied to interpret various observations. However, to date there is no study of the uncertainty estimation of this method. We here present the detailed assessment of this method using a three-dimensional (3D) electron density in the corona from 1.5 to 4 solar radius as a model, which is reconstructed by a tomography method from STEREO/COR1 observations during the solar minimum in February 2008 (Carrington Rotation, CR 2066).We first show in theory and observation that the spherically symmetric polynomial approximation (SSPA) method and the Van de Hulst inversion technique are equivalent. Then we assess the SSPA method using synthesized pB images from the 3D density model, and find that the SSPA density values are close to the model inputs for the streamer core near the plane of the sky (POS) with differences generally smaller than about a factor of two; the former has the lower peak but extends more in both longitudinal and latitudinal directions than the latter. We estimate that the SSPA method may resolve the coronal density structure near the POS with angular resolution in longitude of about 50 deg. Our results confirm the suggestion that the SSI method is applicable to the solar minimum streamer (belt), as stated in some previous studies. In addition, we demonstrate that the SSPA method can be used to reconstruct the 3D coronal density, roughly in agreement with the reconstruction by tomography for a period of low solar activity (CR 2066). We suggest that the SSI method is complementary to the 3D tomographic technique in some cases, given that the development of the latter is still an ongoing research effort.

corona↗
NASA NTRS1976

Diamagnetic boundary layers - A kinetic theory

A kinetic theory is presented for boundary layers associated with MHD tangential 'discontinuities' in a collisionless magnetized plasma, such as those observed in the solar wind. The theory consists of finding self-consistent solutions of Vlasov's equation and Maxwell's equation for stationary one-dimensional boundary layers separating two Maxwellian plasma states. Layers in which the current is carried by electrons are found to have a thickness of the order of a few electron gyroradii, but the drift speed of the current-carrying electrons is found to exceed the Alfven speed, and accordingly such layers are not stable. Several types of layers in which the current is carried by protons are discussed; in particular, cases are considered in which the magnetic-field intensity, direction, or both, changed across the layer. In every case, the thickness was of the order of a few proton gyroradii, and the field changed smoothly, although the characteristics depended somewhat on the boundary conditions. The drift speed was always less than the Alfven speed, consistent with stability of such structures. These results are consistent with observations of boundary layers in the solar wind near 1 AU.

Lemaire, J.↗
NASA NTRS2009

The Lunar Regolith as a Remote Sensing Target for the Lunar Reconnaissance Orbiter (LRO)

Of the 6 instruments and one technology demonstration aboard the LRO, only CRaTER does not measure some kind of interaction of particles with the lunar regolith. LEND detects neutron fluence that contains information about the number density of protons in the upper regolith. To infer the presence of protons, the PI must assume a model that characterizes the surface as a collection of atoms. Thus, LEND does not sense the regolith as a structure. LROC, LOLA, and LAMP sense reflected photons whose wavelength is much shorter than the median particle size in the regolith. The photons interact with electrons, either in atomic shells or in chemical bonds. These interactions occur within a nanometer or so of the surface of a particle. Thus, the particles are macroscopic objects and models of the reflection process invoke ray-tracing optics. DIVINER senses photons that have been emitted by surface particles through thermal phonon processes. The wavelengths detected by the instrument are of the same order as the median particle size, and the photons contain information on particle dimensions as well as the molecular bonds in the constituent compounds. The Mini-RF synthetic aperture radar generates and detects photons of a few centimeters wavelength that interact with the regolith as a dielectric, the dielectric properties of the particulate component being described through effective medium theory. However, the interaction with rocks (macroscopic objects of interest to geologists) can be characterized using Fresnel or Mie models of electromagnetic properties.

Mendell, Wendell W.↗
NASA NTRS2022

Evaluating Mineral Lattices as Evolutionary Proxies for Metalloprotein Evolution

Protein coordinated iron-sulfur clusters drive electron flow within metabolic pathways for organisms throughout the tree of life. It is not known how iron-sulfur clusters were first incorporated into proteins. Structural analogies to iron-sulfde minerals present on early Earth, suggest a connection in the evolution of both proteins and minerals. The availability of large protein and mineral crystallographic structure data sets, provides an opportunity to explore co-evolution of proteins and minerals on a large-scale using informatics approaches. However, quantitative comparisons are confounded by the infnite, repeating nature of the mineral lattice, in contrast to metal clusters in proteins, which are fnite in size. We address this problem using the Niggli reduction to transform a mineral lattice to a fnite, unique structure that when translated reproduces the crystal lattice. Protein and reduced mineral structures were represented as quotient graphs with the edges and nodes corresponding to bonds and atoms, respectively. We developed a graph theory-based method to calculate the maximum common connected edge subgraph (MCCES) between mineral and protein quotient graphs. MCCES can accommodate differences in structural volumes and easily allows additional chemical criteria to be considered when calculating similarity. To account for graph size differences, we use the Tversky similarity index. Using consistent criteria, we found little similarity between putative ancient iron-sulfur protein clusters and iron-sulfur mineral lattices, suggesting these metal sites are not as evolutionarily connected as once thought. We discuss possible evolutionary implications of these findings in addition to suggesting an alternative proxy, mineral surfaces, for better understanding the coevolution of the geosphere and biosphere

Kenneth N. McGuinness↗
NASA NTRS2000

Theoretical Study of Indium Compounds of Interest for Organometallic Chemical Vapor Deposition

The structural. electronic and therinochemical properties of indium compounds which are of interest in halide transport and organometallic chemical vapor deposition processes have been studied by ab initio and statistical mechanics methods. The compounds reported include: indium halides and hydrides (InF, InCl, InCl3, InH, InH2, InH3); indium clusters (In2, In3); methylindium, dimethylindium, and their hydrogen derivatives [In(CH3), In(CH3)H, In(CH3)H2, In(CH3)2, In(CH3)2H]; dimethyl-indium dimer [In2(CH3)4], trimethyl-indium [In(CH3)3]; dehydrogenated methyl, dimethyl and trimethylindium [In(CH3)2CH2, In(CH3)CH2, In(CH2)], trimethylindium adducts with ammonia, trimethylamine and hydrazine [(CH3)3In:NH3, (CH3)3In:N(CH3)3, (CH3)3In:N(H2)N(H2)]; dimethylamino-indium and methylimino-indium [In(CH3)2(NH2), In(CH3)(NH)]; indium nitride and indium nitride dimer (InN, In2N2), indium phosphide, arsenide and antimonide ([InP, InAs, InSb). The predicted electronic properties are based on density functional theory calculations; the calculated thermodynamic properties are reported following the format of the JANAF (Joint Army, Navy, NASA, Air Force) Tables. Equilibrium compositions at two temperatures (298 and 1000 K) have been analyzed for groups of competing simultaneous reactions.

Cardelino, B. H.↗
NASA NTRS2019

Highly Structured Slow Solar Wind Emerging From an Equatorial Coronal Hole

At solar minimum, the solar wind is observed at high solar latitudes as a predominantly fast (> 500 km/s), highly Alfvenic, rarefied stream of plasma originating deep within coronal holes, while near the ecliptic plane it is interspersed with a more variable slow (< 500 kms) wind. The precise origins of the slow wind streams are less certain, with theories and observations supporting sources from the tips of helmet streamers, interchange reconnection near coronal hole boundaries, and origins within coronal holes with highly diverging magnetic fields. The heating mechanism required to drive the solar wind is also an open question and candidate mechanisms include Alfven wave turbulence, heating by reconnection in nanoflares, ion cyclotron wave heating and acceleration by thermal gradients1. At 1 au, the wind is mixed and evolved and much of the diagnostic structure of these sources and processes has been lost. Here we present new measurements from Parker Solar Probe at 36 to 54 solar radii that show clear evidence of slow, Alfvenic solar wind emerging from a small equatorial coronal hole. The measured magnetic field exhibits patches of large, intermittent reversals associated with jets of plasma and enhanced Poynting flux and interspersed in a smoother and less turbulent flow with near-radial magnetic field. Furthermore, plasma wave measurements suggest electron and ion velocity-space micro-instabilities that have been identified with plasma heating and thermalization processes. Our measurements suggest an impulsive mechanism associated with solar wind energization and a heating role for micro-instabilities and provide strong evidence for low latitude coronal holes as a significant contribution to the source of the slow solar wind.

Solar physics↗
NASA NTRS1988

Simulated measurement of power flow in structures near to simple sources and simple boundaries

Advances in electronics technology along with the advent of low cost multichannel Fast Fourier analyzers have made it practical to use higher order central difference formulas to measure power flow in 1- and 2-D structures. The method discussed uses five point differencing for the spatial derivatives in 1-D and a thirteen point difference pattern for the spatial derivatives in 2-D plates and shells. It is assumed that the measuring transducers are accelerometers. An analytical study of the higher order differencing method and the conventional two accelerometer method was performed as a preliminary to the application of these methods to actual aircraft structures. Some classical problems were analyzed in order to simulate and compare the performance of the two methods under near field measurement conditions. These near field conditions include examples of power flows near simple sources and simple boundaries. The estimates produced by the two methods were compared to the exact solution in each example. Presented are the theory and selected results of the study, which indicate that the bias errors of the two accelerometer method under near field measurement conditions may be much larger than previous studies have suggested.

Mcgary, Michael C.↗
NASA NTRS1996

The calculation of radial dose from heavy ions: predictions of biological action cross sections

The track structure model of heavy ion cross sections was developed by Katz and co-workers in the 1960s. In this model the action cross section is evaluated by mapping the dose-response of a detector to gamma rays (modeled from biological target theory) onto the radial dose distribution from delta rays about the path of the ion. This is taken to yield the radial distribution of probability for a "hit" (an interaction leading to an observable end-point). Radial integration of the probability yields the cross section. When different response from ions of different Z having the same stopping power is observed this model may be indicated. Since the 1960s there have been several developments in the computation of the radial dose distribution, in the measurement of these distributions, and in new radiobiological data against which to test the model. The earliest model, by Butts and Katz made use of simplified delta ray distribution functions, of simplified electron range-energy relations, and neglected angular distributions. Nevertheless it made possible the calculation of cross sections for the inactivation of enzymes and viruses, and allowed extension to tracks in nuclear emulsions and other detectors and to biological cells. It set the pattern for models of observable effects in the matter through which the ion passed. Here we outline subsequent calculations of radial dose which make use of improved knowledge of the electron emission spectrum, the electron range-energy relation, the angular distribution, and some considerations of molecular excitation, of particular interest both close to the path of the ion and the outer limits of electron penetration. These are applied to the modeling of action cross sections for the inactivation of several strains of E-coli and B. subtilis spores where extensive measurements in the "thin-down" region have been made with heavy ion beams. Such calculations serve to test the radial dose calculations at the outer limit of electron penetration. We lack data from which to test these calculations in regions close to the path of the ion aside from our earliest work on latent tracks in plastics, though it appears that the criterion then suggested for the threshold of track formation, of a minimal dose at a minimal distance (of about 20 angstroms, in plastics), remains valid.

NASA Discipline Radiation Health↗
NASA NTRS1991

Investigation of the structure of the electromagnetic field and related phenomena, generated by the Active Satellite

The altitude dependencies of the moduli of the electric field E in the VLF and LF frequency bands (f sub B much less than F less than f sub B) and in the altitude range of the ionosphere Z equals (400 to 2500) km up to Z equals 6000 km (the bottom of the magnetosphere) were calculated by the linear theory. The amplitudes of the field have large maxima in four regions: the axis field (E sub o) close to the direction of the Earth's magnetic field line B sub o, beta approximately 0 degrees, the fields (E sub St), (E sub RevSt) and (E sub Res) in the Storey, Reversed Story and Resonance cones, beta approximately (0 approaches 20) degrees. Their maxima are very pronounced close to the low hybrid frequency F sub L. The nonlinear heating of the magnetoplasma under the action of an electric field Ee (sup iwt) was recently expanded by the macroscopic theory by the author. The velocities, collision frequencies and temperatures of all the constituents of a magnetoplasma - electrons, ions, and neutral particles - are taken into account. Formulae and numerical results are presented for the ionosphere in the frequency band F equals (1 to 10 exp 4) kHz and altitude range Z approximately (100 - 1000) km. Some results of calculations by the self consistent solution of the basis system of equations are also discussed.

Alpert, Yakov L.↗
NASA NTRS1986

Simultaneous rocket and MST radar observation of an internal gravity wave breaking in the mesosphere

In June, 1983, the Structure and Atmospheric Turbulence Environment (STATE) rocket and Poker Flat Mesophere-Stratosphere-Troposphere radar campaign was conducted to measure the interaction between turbulence, electron density and electron density gradient that has produced unusually strong MST radar echoes from the summer mesosphere over Poker Flat, Alaska. Analysis or radar wind measurements and a concurrent wind and temperature profile obtained from a rocket probe carrying a three-axis accelerometer are given. The two data sets provide a fairly complete (and in some cases, redundant) picture of the breaking (or more correctly, the saturation) of a large-amplitude, low-frequency, long-wavelength internal gravity wave. The data show that small-scale turbulence and small-scale wave intensity is greatest at those altitudes where the large-scale wave-induced temperature lapse rate is most negative or most nearly unstable, but the wind shear due to the large-scale wave is a minimum. A brief review of linear gravity-wave theory is presented as an aid to the identification of the gravity-wave signature in the radar and rocket data. Analysis of the time and height cross sections of wind speed and turbulence intensity observed by the Poker Flat MST radar follows. Then, the vertical profile of temperature and winds measured by a rocket probe examined. Finally, the use of the independent data sets provided by the rocket and the radar are discussed and implications for theories of wave saturation are presented.

Smith, S. A.↗