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Results for “Self-consistent calculations”

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 181 records · Page 10
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NASA NTRS1989

Calculation of the electron wave function in a graded-channel double-heterojunction modulation-doped field-effect transistor

Three double-heterojunction modulation-doped field-effect transistor structures with different channel composition are investigated theoretically. All of these transistors have an In(x)Ga(1-x)As channel sandwiched between two doped Al(0.3)Ga(0.7)As barriers with undoped spacer layers. In one of the structures, x varies from 0 from either heterojunction to 0.15 at the center of the channel quadratically; in the other two, constant values of x of 0 and 0.15 are used. The Poisson and Schroedinger equations are solved self-consistently for the electron wave function in all three cases. The results showed that the two-dimensional electron gas (2DEG) concentration in the channel of the quadratically graded structure is higher than the x = 0 one and slightly lower than the x = 0.15 one, and the mean distance of the 2DEG is closer to the center of the channel for this transistor than the other two. These two effects have important implications on the electron mobility in the channel.

Mui, D. S. L.↗
NASA NTRS1989

Theoretical study of metal noble-gas positive ions

Theoretical calculations have been performed to determine the spectroscopic constant for the ground and selected low-lying electronic states of the transition-metal noble-gas ions Var(+), FeAr(+), CoAr(+), CuHe(+), CuAr(+), and CuKr(+). Analogous calculations have been performed for the ground states of the alkali noble-gas ions LiAr(+), LiKr(+), NaAr(+), and KAr(+) and the alkaline-earth noble-gas ion MgAr(+) to contrast the difference in binding energies between the simple and transition-metal noble-gas ions. The binding energies increase with increasing polarizability of the noble-gas ions, as expected for a charge-induced dipole bonding mechanism. It is found that the spectroscopic constants of the X 1Sigma(+) states of the alkali noble-gas ions are well described at the self-consistent field level. In contrast, the binding energies of the transition-metal noble-gas ions are substantially increased by electron correlation.

Bauschlicher, Charles W., Jr.↗
NASA NTRS1978

Effect of temperature coupling on ozone depletion prediction

The effects of chlorine perturbations on both the temperature and the ozone distribution in the stratosphere have been studied using a simplified radiative-photochemical model. The model solves the hydrostatic equation for total density in a self-consistent manner as the temperature is changed. Radiative coupling is found to have a significant effect on both the thermal structure and the ozone distribution, particularly in the 35-50-km region. By increasing the ClX mixing ratio by 5.0 ppbv, the temperature in this region is decreased by 5 to 10 K with a slight increase below 30 km. The local ozone depletion around 40 km due to added ClX is smaller compared with the estimate made by keeping the temperature fixed to the ambient condition. However, the integrated effect of radiative coupling is to increase the calculated column ozone depletion by 15% to 25% in this model.

Chandra, S.↗
NASA NTRS1987

On the global mean structure of the thermosphere

A self-consistent model of the global mean structure of the thermosphere is used to examine the ionospheric and thermospheric processes that control the structure of the thermosphere for solar minimum and maximum conditions during geomagnetic quiet periods. The model includes the physical and chemical processes believed to be dominant in the thermosphere and ionosphere. The total solar energy input available in the extreme ultraviolet and in the Schumann-Runge continuum portion of the solar spectrum is 14.1 x 10 to the 11th W and 21.5 x 10 to the 11th W for solar minumum and maximum, respectively. The calculated exospheric temperature is too small if maintained only by radiative processes, and an auroral heat source is necessary to bring the calculated global mean structure into agreement with the MSIS-83 empirical model for both solar minimum and maximum conditions. These results support the consensus that there is high-latitude heat source present at all times.

Roble, R. G.↗
NASA NTRS1989

Monte Carlo simulation of particle acceleration at astrophysical shocks

A Monte Carlo code was developed for the simulation of particle acceleration at astrophysical shocks. The code is implemented in Turbo Pascal on a PC. It is modularized and structured in such a way that modification and maintenance are relatively painless. Monte Carlo simulations of particle acceleration at shocks follow the trajectories of individual particles as they scatter repeatedly across the shock front, gaining energy with each crossing. The particles are assumed to scatter from magnetohydrodynamic (MHD) turbulence on both sides of the shock. A scattering law is used which is related to the assumed form of the turbulence, and the particle and shock parameters. High energy cosmic ray spectra derived from Monte Carlo simulations have observed power law behavior just as the spectra derived from analytic calculations based on a diffusion equation. This high energy behavior is not sensitive to the scattering law used. In contrast with Monte Carlo calculations diffusive calculations rely on the initial injection of supra-thermal particles into the shock environment. Monte Carlo simulations are the only known way to describe the extraction of particles directly from the thermal pool. This was the triumph of the Monte Carlo approach. The question of acceleration efficiency is an important one in the shock acceleration game. The efficiency of shock waves efficient to account for the observed flux of high energy galactic cosmic rays was examined. The efficiency of the acceleration process depends on the thermal particle pick-up and hence the low energy scattering in detail. One of the goals is the self-consistent derivation of the accelerated particle spectra and the MHD turbulence spectra. Presumably the upstream turbulence, which scatters the particles so they can be accelerated, is excited by the streaming accelerated particles and the needed downstream turbulence is convected from the upstream region. The present code is to be modified to include a better description of particle scattering (pitch-angle instead of hard-sphere) and as iterative procedure for treating the self-excitation of the MHD turbulence.

Campbell, Roy K.↗
NASA NTRS1974

Temperature and density structure of thermal proton flows

Thermal proton flows along magnetic field lines are an important feature of magnetosphere-ionosphere coupling. In this paper we report the results of a theoretical study of the thermal structure of such flows. The adopted steady state model is based upon O+, H+, and electrons with self-consistent solutions for the separate O+, H+, and electron temperatures, the O+ and H+ densities and the H+ drift velocity. Through investigation of a number of parameters affecting the model, it is shown that Joule heating arising from the flow of H+ through O+ preferentially heats H+, so that the H+ temperature is substantially greater than the O+ temperature. Low O+ densities characteristic of the trough region appear to give high H+/O+ temperature ratios. Typical O+ densities characteristic of polar wind flow regions give moderate H+/O3 temperature ratios. The Mach number of H+ outflow is substantially reduced in the present models in comparison with the older fixed temperature calculations.

Banks, P. M.↗
NASA NTRS1989

Cyclotron resonant scattering in the spectra of gamma-ray bursts

Fits of theoretical spectra from Monte Carlo radiation-transfer calculations to dips at approximately 20 and 40 keV in a spectrum of the gamma-ray burst source GB 880 205 give best-fit values and 68 percent-confidence intervals for the magnetic field of (1.71 + or - 0.07) x 10 to the 12th G, the electron density of (1.2 + or - 0.6) x 10 to the 21st electrons/cm-squared, and the cosine of the viewing angle relative to the field of 0.31 + or - 0.05. The dips observed at approximately 20 keV in the spectra are interpreted as cyclotron resonant scattering, in which electrons undergo radiative 0 to 1 to 0 Landau transitions initiated by photons near the first harmonic. Physical self-consistency fixes the temperature, and the equilibrium temperature equals 5.3 + 0.3 or - 0.2 keV. These results suggest that this gamma-ray burst and many others which exhibit a low-energy dip originate from strongly magnetic neutron stars and are galactic in origin.

Wang, J. C. L.↗
NASA NTRS1978

On the stability of self-consistent large amplitude waves in a cold plasma. I - Transverse circularly polarized waves in the absence of a large scale magnetic field

It is demonstrated that a self-consistent circularly polarized wave in an otherwise field-free homogeneous cold plasma is unstable to small amplitude perturbations. For either an electron-positron plasma or an electron-proton plasma the instability rate is at least about the order of the effective plasma frequency when the bulk flow speed is zero. For finite bulk flow speeds of the plasma, it is shown that the electron-positron plasma is unstable, again with a growth rate of the order of the effective plasma frequency; it is also shown that the electron-proton plasma is unstable (at least at small wave numbers, k) with a growth rate proportional to k. The calculated instability rates are conservative, for other modes not investigated here may be more unstable. The results of these calculations bear directly on the understanding of plasma systems thought to be driven by large amplitude waves.

Lee, M. A.↗
NASA NTRS1981

Simulation of the current-driven electrostatic ion cyclotron instability

Results are presented of a self-consistent particle simulation of the growth and saturation of electrostatic ion cyclotron (EIC) waves along auroral field lines. The driving mechanism for the waves is an initial drifting Maxwellian distribution for the electrons. The magnetic field is taken to lie in the simulation plane, so that modes such as the ion acoustic instability and the EIC instability can be excited, thus making it possible to study the behavior of EIC waves in the presence of ion acoustic turbulence. A dc electric field, which tends to keep the current constant along the field lines, is included. It is shown that the EIC instability grows to a moderate level before saturating due to plateau formation. The perpendicular ion temperature increases by typically 40%, with an increase arising from bulk heating only. The anomalous resistivity, associated with the EIC instability is determined and compared with previous calculations and with that due to the ion acoustic instability. Implications of the results for observation of ion cyclotron waves on auroral field lines are discussed.

Pritchett, P. L.↗
NASA NTRS1990

Localization effects in radiationally disordered high-temperature superconductors: Theoretical interpretation

Theoretical interpretation of recent experiments on radiationally disordered high-temperature superconductors is presented, based on the concepts of mutual interplay of Anderson localization and superconductivity. Microscopic derivation of Ginzburg-Landau coefficients for the quasi-two-dimensional system in the vicinity of localization transition is given in the framework of the self-consistent theory of localization. The 'minimal metallic conductivity' for the quasi-two-dimensional case is enhanced due to a small overlap of electronic states on the nearest neighbor conducting planes. This leads to a stronger influence of localization effects than in ordinary (three-dimensional) superconductors. From this point of view even the initial samples of high-temperature superconductors are already very close to Anderson transition. Anomalies of H(c2) are also analyzed, explaining the upward curvature of H(c2)(T) and apparent independence of dH(c2)/dT (T = T(sub c)) on the degree of disorder as due to localization effects. Researchers discuss the possible reasons of fast T(sub c) degradation due to the enhanced Coulomb effects caused by the disorder induced decrease of localization length. The appearance and growth of localized magnetic moments is also discussed. The disorder dependence of localization length calculated from the experimental data on conductivity correlates reasonably with the theoretical criterion for suppression of superconductivity in the system with localized electronic states.

Goshchitskii, B. N.↗
NASA NTRS1977

Departures of the electron energy distribution from a Maxwellian in hydrogen. I - Formulation and solution of the electron kinetic equation. II - Consequences

The problem of calculating the steady-state free-electron energy distribution in a hydrogen gas is considered in order to study departures of that distribution from a Maxwellian at sufficiently low degrees of ionization. A model kinetic equation is formulated and solved analytically for the one-particle electron distribution function in a steady-state partially ionized hydrogen gas, and it is shown that the formal solution can be accurately approximated by using the WKB method. The solutions obtained indicate that the high-energy tail of the distribution is susceptible to distortion by imbalanced inelastic collisions for ionization fractions not exceeding about 0.1 and that such departures from a Maxwellian can lead to significant changes in the collisional excitation and ionization rates of ground-state hydrogen atoms. Expressions for the electron-hydrogen collision rates are derived which explicitly display their dependence on the hydrogen departure coefficients. The results are applied in order to compare self-consistent predictions with those based on the a priori assumption of a Maxwellian distribution for models of the thermal ionization equilibrium of hydrogen in the optically thin limit, spectral-line formation by a gas consisting of two-level atoms, and radiative transfer in finite slabs by a gas of four-level hydrogen atoms.

Shoub, E. C.↗
NASA NTRS1986

Nonlinear analysis of a relativistic beam-plasma cyclotron instability

A self-consistent set of nonlinear and relativistic wave-particle equations are derived for a magnetized beam-plasma system interacting with electromagnetic cyclotron waves. In particular, the high-frequency cyclotron mode interacting with a streaming and gyrating electron beam within a background plasma is considered in some detail. This interaction mode may possibly find application as a high-power source of coherent short-wavelength radiation for laboratory devices. The background plasma, although passive, plays a central role in this mechanism by modifying the dielectric properties in which the magnetized electron beam propagates. For a particular choice of the transverse beam velocity (i.e., the speed of light divided by the relativistic mass factor), the interaction frequency equals the nonrelativistic electron cyclotron frequency times the relativistic mass factor. For this choice of transverse beam velocity the detrimental effects of a longitudinal beam velocity spread is virtually removed. Power conversion efficiencies in excess of 18 percent are both analytically calculated and obtained through numerical simulations of the wave-particle equations. The quality of the electron beam, degree of energy and pitch angle spread, and its effect on the beam-plasma cyclotron instability is studied.

Sprangle, P.↗
NASA NTRS1978

Structure of current sheets in magnetic holes at 1 AU

Current density profiles in several types of interplanetary magnetic holes were calculated assuming that the currents flow in planar sheets and that the magnetic field varies only in the direction normal to the sheet. The planarity was verified in four holes which were observed by two suitably spaced spacecraft. The structure of the current sheets ranges from very simple in some holes to very complex in others. The observed structures are found to be qualitatively consistent with models based on self-consistent solutions of Vlasov's equation and Maxwell's equations. Examples of complex, irregular magnetic holes are also presented, and they are shown to contain multiple, current sheets in which currents flow parallel to one another.

Fitzenreiter, R. J.↗
NASA NTRS1979

Negative streamer development in FEP teflon

A computational model is developed which describes the evolution and propagation of an ionizing front (negative streamer) in solid materials. The ionization front consists of drifting avalanching electrons moving self-consistently under the influence of their own space-charge field together with an applied external field. The required input information for the model consists of the functional dependence of the macroscopic transport coefficients on the local electric field, the initial conditions for beginning the calculation, and the strength of the applied field. A computational approach for specifying the transport coefficients and initional conditions is also described. The approach has been implemented by constructing three computer codes which sequentially interface, beginning with single electron scattering, and ending with streamer development. Computational results are presented for model calculations in Teflon. The overall model is perceived to provide a picture of the initiation phase of a propagating discharge in electron-irradiated dielectrics.

Beers, B. L.↗
NASA NTRS1982

Quantum-chemical modeling of smectite clays

A self-consistent charge extended Hueckel program is used in modeling isomorphic substitution of Al(3+) by Na(+), K(+), Mg(2+), Fe(2+), and Fe(3+) in the octahedral layer of a dioctahedral smectite clay, such as montmorillonite. Upon comparison of the energies involved in the isomorphic substitution, it is found that the order for successful substitution is as follows: Al(3+), Fe(3+), Mg(2+), Fe(2+), Na(+), which is equivalent to Ca(2+), and then K(+). This ordering is found to be consistent with experimental observation. The calculations also make it possible to determine the possible penetration of metal ions into the clay's 2:1 crystalline layer. For the cases studied, this type of penetration can occur at elevated temperatures into regions where isomorphic substitution has occurred with metal ions that bear a formal charge of less than 3+. The computed behavior of the electronic structure in the presence of isomorphic substitution is found to be similar to behavior associated with semiconductors.

Aronowitz, S.↗
NASA NTRS1986

Production of flickering aurora and field-aligned electron flux by electromagnetic ion cyclotron waves

Recent observations have suggested that flickering aurora is produced by a modulation of the field-aligned component of the electron flux within an auroral arc. It is proposed that a portion of the field-aligned electrons are of ionospheric origin and that these electrons are accelerated and their flux modulated by electromagnetic ion cyclotron waves that occur below the main acceleration region on auroral arc field lines. A model of the electromagnetic ion cyclotron wave shows that the parallel phase velocity of the wave increase as the wave propagates toward the ionosphere. A test particle calculation shows that ionospheric electrons trapped or reflected by the wave are accelerated to energies of several keV and that their flux is modulated at the wave frequency. The relative amplitudes of the model wave electric fields are consistent with the observations of small-scale low-frequency ionospheric and magnetospheric electric fields near auroral arcs of approximately 10 mV/m and 100 mV/m, respectively. The large-amplitude ion cyclotron waves also produce a ponderomotive force and a self-consistent ambipolar electric field. Energy considerations show that the downward energy flux in the electromagnetic ion cyclotron wave can be several percent of the total downward auroral electron energy flux.

Temerin, M.↗
NASA NTRS1986

On the tidal interaction between protoplanets and the primordial solar nebula. II - Self-consistent nonlinear interaction

A method to analyze the full nonlinear response and physical processes associated with the tidal interaction between a binary system and a thin disk in the steady state is presented. Using this approach, density wave propagation, induced by tidal interaction, may be studied for a wide range of sound speeds and viscosities. The effect of self-gravity may also be incorporated. The results of several calculations relevant to the tidal interaction between a protoplanet and the primordial solar nebula are also presented.

Lin, D. N. C.↗
NASA NTRS1989

Renormalization group analysis of turbulence

The objective is to understand and extend a recent theory of turbulence based on dynamic renormalization group (RNG) techniques. The application of RNG methods to hydrodynamic turbulence was explored most extensively by Yakhot and Orszag (1986). An eddy viscosity was calculated which was consistent with the Kolmogorov inertial range by systematic elimination of the small scales in the flow. Further, assumed smallness of the nonlinear terms in the redefined equations for the large scales results in predictions for important flow constants such as the Kolmogorov constant. It is emphasized that no adjustable parameters are needed. The parameterization of the small scales in a self-consistent manner has important implications for sub-grid modeling.

Smith, Leslie M.↗