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At least 145 records · Page 8
All sourcesNASA NTRSDOE OSTI
NASA NTRS1988

On convection-induced viscosity in accretion disks in cataclysmic variables

The vertical structure of accretion disks in cataclysmic variable systems is examined on the assumption that the convection is solely responsible for inducing the viscous heating. The viscous heating is distributed over the entire vertical structure so that purely radiative zones are able to carry a radial mass flux. The convective flux is computed by two different methods in separate calculations and the results from each method are compared. The values of the viscosity obtained are compared with those values inferred from the observed time scales of dwarf nova eruptions. Sequences of equilibrium solutions for constant radius and varying mass accretion rate are examined, the relations between viscosity and surface density are discussed in the context of recent models for the eruptions of dwarf novae.

Cannizzo, John K.↗
NASA NTRS1989

Nonlinear Parker instability of isolated magnetic flux in a plasma

The nonlinear evolution of the Parker instability in an isolated horizontal magnetic-flux sheet embedded in a two-temperature layer atmosphere is studied by using a two-dimensional MHD code. In the solar case, this two-layer model is regarded as a simplified abstraction of the sun's photosphere/chromosphere and its overlying much hotter (coronal) envelope. The horizontal flux sheet is initially located in the lower temperature atmosphere so as to satisfy magnetostatic equilibrium under a constant gravitational acceleration. Ideal MHD is assumed, and only perturbations with k parallel to the magnetic-field lines are investigated. As the instability develops, the gas slides down the expanding loop, and the evacuated loop rises as a result of enhanced magnetic buoyancy. In the nonlinear regime of the instability, both the rise velocity of a magnetic loop and the local Alfven velocity at the top of the loop increase linearly with height and show self-similar behavior with height as long as the wavelength of the initial perturbation is much smaller than the horizontal size of the computing domain.

Shibata, K.↗
NASA NTRS1991

An approximate analytical solution for interlaminar stresses in angle-ply laminates

An improved approximate analytical solution for interlaminar stresses in finite width, symmetric, angle-ply laminated coupons subjected to axial loading is presented. The solution is based upon statically admissible stress fields which take into consideration local property mismatch effects and global equilibrium requirements. Unknown constants in the admissible stress states are determined through minimization of the complementary energy. Typical results are presented for through-the-thickness and interlaminar stress distributions for angle-ply laminates. It is shown that the results represent an improved approximate analytical solution for interlaminar stresses.

Rose, Cheryl A.↗
NASA NTRS1991

Mars entry-to-landing trajectory optimization and closed loop guidance

The guidance strategy of the Mars Rover Sample Return mission is presented in detail. Aeromaneuver versus aerobrake trades are examined, and an aerobrake analysis is presented which takes into account targeting, guidance, flight control, trajectory profile, delivery accuracy. An aeromaneuver analysis is given which includes the entry corridor, maneuver footprint, guidance, preentry phase, constant drag phase, equilibrium guide phase, variable drag phase, influence of trajectory profile on the entry flight loads, parachute deployment conditions and strategies, and landing accuracy. The Mars terminal descent phase is analyzed.

Ilgen, Marc R.↗
NASA NTRS1993

An approximate solution for interlaminar stresses in composite laminates

An efficient approximate solution for interlaminar stresses in finite width, symmetric and unsymmetric laminated composites subjected to axial and/or bending loads is presented. The solution is based upon statically admissible stress fields which take into consideration local property mismatch effects and global equilibrium requirements. Unknown constants in the assumed stress states are determined through minimization of the laminate complementary energy. Typical results are presented for through-thickness and interlaminar stress distributions for angle-ply and cross-ply laminates subjected to axial loading. It is shown that the present formulation represents an improved, efficient approximate solution for interlaminar stresses.

Rose, Cheryl A.↗
NASA NTRS1991

Equilibrium wave spectrum and sea state bias in satellite altimetry

For a well-developed sea at equilibrium with a constant wind, the energy-containing range of the wavenumber spectrum for wind-generated gravity waves is approximated by a generalized power law involving the angular spread function and mu, interpreted as a fractal codimension of a small surface patch. Dependence of mu on the wave age is estimated, and the 'Phillips constant', beta, along with the low-wavenumber boundary, k0, of the inertial subrange are analyzed on the basis of the wave action and energy conservation principles. The resulting expressions are employed to evaluate various non-Gaussian statistics of a weakly nonlinear sea surface, which determine the sea state bias in satellite altimetry. The locally accelerated decay of the spectral density function in a high-wavenumber dissipation subrange is pointed out as an important factor of wave dynamics and the geometrical optics treatment of the sea state bias. The analysis is carried out in the approximation of a unidirectional wave field and confined to the case of a well-developed sea.

Glazman, Roman E.↗
NASA NTRS1995

A Correlated Ab Initio Study of Linear Carbon-Chain Radicals C(sub n)H (n=2-7)

Linear carbon-chain radicals C(sub n) H for n = 2-7 have been studied with correlation consistent valence and core-valence basis sets and the coupled cluster method RCCSD(T). Equilibrium structures, rotational constants, and dipole moments are reported and compared with available experimental data. The ground state of the even-n series changes from 2Sigma(+) to 2Pi as the chain is extended. For C4H, the 2Sigma(+) state was found to lie only 72 cm(exp -1) below the 2Pi state in the estimated complete basis set limit for valence correlation. The C2H(-) and C3H(-) anions have also been characterized.

Woon, David E.↗
NASA NTRS1995

A correlated ab initio study of linear carbon-chain radicals CnH (n = 2-7)

Linear carbon-chain radicals CnH for n = 2-7 have been studied with correlation consistent valence and core-valence basis sets and the coupled cluster method RCCSD(T). Equilibrium structures, rotational constants, and dipole moments are reported and compared with available experimental data. The ground state of the even-n series changes from 2 sigma+ to 2 pi as the chain is extended. For C4H, the 2 sigma+ state was found to lie only 72 cm-1 below the 2 pi state in the estimated complete basis set limit for valence correlation. The C2H- and C3H- anions have also been characterized.

NASA Discipline Exobiology↗
NASA NTRS2001

Simplified Analysis of Pulse Detonation Rocket Engine B1owdown Gasdynamics and Performance

Pulsed detonation rocket engines (PDREs) have generated considerable research interest in recent years as a chemical propulsion system potentially offering improved performance and reduced complexity compared to conventional rocket engines. The detonative mode of combustion employed by these devices offers a thermodynamic advantage over the constant-pressure deflagrative combustion mode used in conventional rocket engines and gas turbines. However, while this theoretical advantage has spurred a great deal of interest in building PDRE devices, the unsteady blowdown process intrinsic to the PDRE has made realistic estimates of the actual propulsive performance problematic. The recent review article by Kailasanath highlights some of the difficulties in comparing the available experimental measurements with numerical models. The goal of this paper is to improve understanding of PDRE blowdown gasdynamics and performance issues through use of a simplified model that captures the essential features of the unsteady blowdown process, and yet remains computationally inexpensive. The PDRE system studied here is highly idealized, consisting of a constant-area detonation tube with one end closed and the other end open to the environment. The tube is prefilled with a gaseous propellant mixture with no initial velocity or outflow to the environment. The detonation is initiated instantaneously at the closed end of the device. Chapman-Jouguet (C-J) post-detonation gas conditions are calculated using the CET89 version of the NASA thermochemical code. The I-D, unsteady method of characteristics is used to calculate the flowfield following the detonation front. See the compressible flow texts by Thompson and Zucrow and Hoffman for details of this method. Parametric studies of the effect of mixture stoichiometry, fill temperature, and blowdown pressure ratio on performance are reported. A comparison of the performance of an idealized straight-tube PDRE with a conventional steady-state rocket engine is provided. The effect of constant-gamma and equilibrium chemistry assumptions is also examined. Additionally, in order to form an assessment of the accuracy of the model, the flowfield time history is compared to experimental data from Stanford University.

Morris, Christopher I.↗
DOE OSTI2024

EF-Hand Battle Royale: Hetero-ion Complexation in Lanmodulin

The lanmodulin (LanM) protein has emerged as an effective means for rare earth element (REE) extraction and separation from complex feedstocks without the use of organic solvents. Whereas the binding of LanM to individual REEs has been well characterized, little is known about the thermodynamics of mixed metal binding complexes (i.e., heterogeneous ion complexes), which limits the ability to accurately predict separation performance for a given metal ion mixture. In this paper, we employ the law of mass action to establish a theory of perfect cooperativity for LanM-REE complexation at the two highest-affinity binding sites. The theory is then used to derive an equation that explains the nonintuitive REE binding behavior of LanM, where separation factors for binary pairs of ions vary widely based on the ratio of ions in the aqueous phase, a phenomenon that is distinct from single-ion-binding chemical chelators. We then experimentally validate this theory and perform the first quantitative characterization of LanM complexation with heterogeneous ion pairs using resin-immobilized LanM. Importantly, the resulting homogeneous and heterogeneous constants enable accurate prediction of the equilibrium state of LanM in the presence of mixtures of up to 10 REEs, confirming that the perfect cooperativity model is an accurate mechanistic description of REE complexation by LanM. We further employ the model to simulate separation performance over a range of homogeneous and heterogeneous binding constants, revealing important insights into how mixed binding differentially impacts REE separations based on the relative positioning of the ion pairs within the lanthanide series. In addition to informing REE separation process optimization, these results provide mathematical and experimental insight into competition dynamics in other ubiquitous and medically relevant, cooperative binding proteins, such as calmodulin.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1995

Heating and ionization of stellar chromospheres by nonthermal proton beams: Implications for impulsive phase, redshifted Lyman-alpha radiation in stellar flares

We investigate the physical basis for the timescale of impulsive-phase, redshifted Lyman-alpha emission in stellar flares on the assumption that it is determined by energy losses in a nonthermal proton beam that is penetrating the chromosphere from above. The temporal evolution of ionization and heating in representative model chromospheres subjected to such beams is calculated. The treatment of 'stopping' of beam protons takes into account their interactions with (1) electrons bound in neutral hydrogen, (2) nuclei of neutral hydrogen, (3) free electrons, and (4) ambient thermal protons. We find that, for constant incident beam flux, the system attains an equilibrium with the beam energy input to the chromosphere balanced by radiative losses. In equilibrium, the beam penetration depth is constant, and erosion of the chromosphere ceases. If the redshifted, impulsive-phase stellar flare Lyman-alpha emission is produced by downstreaming hydrogen formed through charge exchange between beam protons and ambient hydrogen, then the emission should end when the beam no longer reaches neutral hydrogen. The durations of representative emission events calculated on this assumption range from 0.1 to 14 s. The stronger the beam, the shorter the timescale over which the redshifted Lyman-alpha emission can be observed.

Brosius, Jeffrey W.↗
DOE OSTI2024

Reductive Dynamic and Static Excited State Quenching of a Homoleptic Ruthenium Complex Bearing Aldehyde Groups

A new homoleptic Ru polypyridyl complex bearing two aldehyde groups on each bipyridine ligand, [Ru(dab) 3 ](PF 6 ) 2 , where dab is 4,4′-dicarbaldehyde-2,2′-bipyridine, was synthesized, characterized, and utilized for iodide photo-oxidation studies. In acetonitrile (CH 3 CN) solution, the complex displayed an intense metal-to-ligand charge transfer (MLCT) absorbance maximum at 475 nm (ε = 22,000 M –1 cm –1 ) and an infrared (IR) band at 1712 cm –1 assigned to the pendent aldehyde groups. Visible light excitation in air-saturated solution resulted in room temperature photoluminescence (PL) with a maximum at 675 nm, a quantum yield, ϕ PL = 0.048, and an excited state lifetime, τ ο = 440 ns, from which radiative and nonradiative relaxation rate constants were extracted, k r = 9.1 × 10 4 s –1 and knr = 1.8 × 10 6 s –1 . Pulsed visible light excitation yielded transient UV–vis and IR absorption spectra consistent with an MLCT excited state; relaxation occurred with the maintenance of two isosbestic points in the visible region, and a lifetime that agreed with that measured by time-resolved PL. Cyclic voltammetry studies in a CH 3 CN solution with 0.1 M TBAPF 6 electrolyte revealed a quasi-reversible oxidation, E°(Ru III/II ) = +1.25 V vs. Fc +/0 , and three sequential one-electron reductions at −1.10, −1.25, and −1.54 V vs. Fc +/0 . Here, an excited state reduction potential of E°(Ru *2+/+ ) = +0.89 V vs. Fc +/0 was estimated with the Rehm–Weller expression. Titration of tetrabutylammonium iodide, TBAI, into a CD 3 CN solution of [Ru(dab) 3 ](PF 6 ) 2 resulted in significant shifts in the aldehyde H atom and 3,3′-biypridyl resonances that were analyzed with a 1:1 equilibrium model, from which K eq = 460 M –1 was extracted, increasing to 5800 M –1 when the solvent was changed to acetone-d 6 . Iodide titrations resulted in a significant quenching of the [Ru(dab) 3 ] *2+ lifetime and quantum yield in both CH 3 CN and acetone solvents. In CH 3 CN, the quenching was mainly dynamic and well described by the Stern–Volmer model, from which a quenching rate constant, k q , of 4.5 × 10 10 M –1 s –1 and an equilibrium constant, K eq , of 8.3 × 10 3 M –1 were obtained. In acetone, the static quenching pathway by iodide was greatly enhanced, with a K eq of 1.2 × 10 4 M –1 and a higher k q of 9.2 × 10 10 M –1 s –1 .

Aldehydes↗
NASA NTRS1993

Direct numerical simulation of turbulent H2-O2 combustion using reduced chemistry

Results of direct numerical simulations of hydrogen-oxygen combustion using a partial-equilibrium chemistry scheme in constant density, decaying, isotropic turbulence are reported. The simulations qualitatively reproduce many features of experimental results, such as superequilibrium radical species mole fractions, with temperature and major species mole fractions closer to chemical equilibrium. It was also observed that the peak reaction rates occur in narrow zones where the stoichiometric surface intersects regions of high scalar dissipation, as might be expected for combustion conditions close to chemical equilibrium. Another finding was that high OH mole fraction correspond more closely to the stoichiometric surface than to areas of high reaction rate for conditions of the simulations. Simulation results were compared to predictions of the Conditional Moment Closure model. This model was found to give good results for all quantities of interest when the conditionally averaged scalar dissipation was used in the prediction. When the nonconditioned average dissipation was used, the predictions compared well to the simulations for most of the species and temperature, but not for the reaction rate. The comparison would be expected to improve for higher Reynolds number flows, however.

Montgomery, Christopher J.↗
NASA NTRS1990

Acoustic positioning and orientation prediction

A method is described for use with an acoustic positioner, which enables a determination of the equilibrium position and orientation which an object assumes in a zero gravity environment, as well as restoring forces and torques of an object in an acoustic standing wave field. An acoustic standing wave field is established in the chamber, and the object is held at several different positions near the expected equilibrium position. While the object is held at each position, the center resonant frequency of the chamber is determined, by noting which frequency results in the greatest pressure of the acoustic field. The object position which results in the lowest center resonant frequency is the equilibrium position. The orientation of a nonspherical object is similarly determined, by holding the object in a plurality of different orientations at its equilibrium position, and noting the center resonant frequency for each orientation. The orientation which results in the lowest center resonant frequency is the equilibrium orientation. Where the acoustic frequency is constant, but the chamber length is variable, the equilibrium position or orientation is that which results in the greatest chamber length at the center resonant frequency.

Barmatz, Martin B.↗
NASA NTRS1986

Thermal stability analysis of the fine structure of solar prominences

The linear thermal stability of a 2D periodic structure (alternatively hot and cold) in a uniform magnetic field is analyzed. The energy equation includes wave heating (assumed proportional to density), radiative cooling and both conduction parallel and orthogonal to magnetic lines. The equilibrium is perturbed at constant gas pressure. With parallel conduction only, it is found to be unstable when the length scale 1// is greater than 45 Mn. In that case, orthogonal conduction becomes important and stabilizes the structure when the length scale is smaller than 5 km. On the other hand, when the length scale is greater than 5 km, the thermal equilibrium is unstable, and the corresponding time scale is about 10,000 s: this result may be compared to observations showing that the lifetime of the fine structure of solar prominences is about one hour; consequently, our computations suggest that the size of the unresolved threads could be of the order of 10 km only.

Demoulin, Pascal↗
NASA NTRS1982

Electric field observations of time constants related to charging and charge neutralization processes in the ionosphere

The Polar 5 electric field results are reviewed, and the transients from Polar 3 are presented. The phenomena are discussed from the standpoint of space charge. On the basis of the Polar 5 results, the large magnitude of the electric field from Polar 3 is seen as indicating that the observed space charge was probably within a few km or less of the payload. Reference is made to Cole's prediction (1960) that charges in the ionosphere would reach equilibrium with a time constant of the order of a few microsec. The processes involved in the two cases presented here require time constants of the order of ms. If the sheath dimensions are taken to be between 50 and 100 m, which is not considered unreasonable in view of the electric field measurements, then a qualitative estimate of the neutralization time would be the transit time for ions across the sheath. Since the kinetic velocity of a 1-eV proton is approximately 14 m/s, it would traverse the distance in 4 to 8 ms, assuming freedom of movement across magnetic field lines. This is the order of the decay times observed on Polar 5.

Maynard, N. C.↗
DOE OSTI2025

Ground and excited state properties of ThB − and ThB: a theoretical study

In the present work, we studied a series of electronic and spin–orbit states of ThB − and ThB using high-level multireference and coupled-cluster theories. We report the potential energy curves (PECs), equilibrium electron configurations, spectroscopic constants, energetics, and spin–orbit coupling effects of 17 and 19 electronic states of ThB − and ThB, respectively. The ground state of ThB − is a single-reference 1 3 Π with a 1σ 2 2σ 2 3σ 1 1π 3 electron configuration. Detachment of an electron from the doubly occupied 1π orbital of ThB − (1 3 Π) produces the single-reference ground electronic state of ThB (1 4 Σ − ). The ground spin–orbit states of ThB − and of ThB are 1 3 Π + 0 and 1 4 Σ − 3/2 , respectively. The vertical electron detachment energy (VDE) of ThB − and the adiabatic electron attachment energy (AEA) of ThB at our largest CBS-C-CCSD(T)+δT(Q)+δSO (complete basis set effect, spin–orbit effect, and triple and perturbative quadruple electron correlation effect added coupled-cluster theory with single, double, and perturbative triple excitations) level are 1.473 eV and 1.459, respectively. The reaction of Th( 3 F) + B( 2 P o ) produces the ground state of ThB with a bond energy of 2.843 eV. Finally, we estimated a heat of formation, Δ H 0 f (298 K), of 891.01 kJ mol −1 for the ThB molecule. The high-level findings of this work are expected to aid and motivate future experimental spectroscopic investigations of ThB and ThB − species.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1982

Sharp edges of planetary rings

The ring systems of Saturn and Uranus exhibit several sharp edges, across which the optical depth drops from order unity to essentially zero. At least two and perhaps all of these features are associated with the location of orbital resonances between a satellite and the ring particles. It is remarkable that the optical depth varies on a distance scale which is much finer than that over which angular momentum can be transferred between a satellite and the ring material. The important features of this phenomenon are: (1) a perturbed band of width Delta a/a of about (satellite mass/planetary mass) to the 1/2 power adjacent to the edge within which the angular momentum transfer occurs, (2) streamlines perturbed such that the angular momentum luminosity decreases smoothly across the band to zero at the edge even though the optical depth remains constant, and (3) dynamical equilibrium requires a relation between the random velocity, the rate of deformation and the optical depth.

Borderies, N.↗