Search NASA⌕ Search

SEARCH · Search NASA

Results for “INTERACTION RANGE”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 847 records · Page 47
All sourcesNASA NTRSDOE OSTI
DOE OSTI2019

Theoretical Determination of Size Effects in Zeolite-Catalyzed Alcohol Dehydration

In the upgrading of biomass pyrolysis vapors to hydrocarbons, dehydration accomplishes a primary objective of removing oxygen, and acidic zeolites represent promising catalysts for the dehydration reaction. Here, we utilized density functional theory calculations to estimate adsorption energetics and intrinsic kinetics of alcohol dehydration over H-ZSM-5, H-BEA, and H-AEL zeolites. The ONIOM (our Own N-layered Integrated molecular Orbital and molecular Mechanics) calculations of adsorption energies were observed to be inconsistent when benchmarked against QM (Quantum Mechanical)/Hartree–Fock and periodic boundary condition calculations. However, reaction coordinate calculations of adsorbed species and transition states were consistent across all levels considered. Comparison of ethanol, isopropanol (IPA), and tert-amyl alcohol (TAA) over these three zeolites allowed for a detailed examination of how confinement impacts on reaction mechanisms and kinetics. The TAA, seen to proceed via a carbocationic mechanism, was found to have the lowest activation barrier, followed by IPA and then ethanol, both of which dehydrate via a concerted mechanism. Barriers in H-BEA were consistently found to be lower than in H-ZSM-5 and H-AEL, attributed to late transition states and either elevated strain or inaccurately estimating long-range electrostatic interactions in H-AEL, respectively. Molecular dynamics simulations revealed that the diffusivity of these three alcohols in H-ZSM-5 were significantly overestimated by Knudsen diffusion, which will complicate experimental efforts to develop a kinetic model for catalytic fast pyrolysis.

09 BIOMASS FUELS↗
DOE OSTI2017

A nearly naked supermassive black hole

During a systematic search for supermassive black holes (SMBHs) not in galactic nuclei, we identified the compact, symmetric radio source B3 1715+425 with an emission-line galaxy offset ≈8.5 kpc from the nucleus of the brightest cluster galaxy (BCG) in the redshift z = 0.1754 cluster ZwCl 8193. B3 1715+425 is too bright (brightness temperature T{sub b}∼3×10{sup 10} K at observing frequency ν=7.6 GHz) and too luminous (1.4 GHz luminosity L{sub 1.4GHz}∼10{sup 25} W Hz{sup −1}) to be powered by anything but an SMBH, but its host galaxy is much smaller (∼0.9 kpc×0.6 kpc full width between half-maximum points) and optically fainter (R-band absolute magnitude M{sub r}≈−18.2) than any other radio galaxy. Its high radial velocity v{sub r}≈1860 km s{sup −1} relative to the BCG, continuous ionized wake extending back to the BCG nucleus, and surrounding debris indicate that the radio galaxy was tidally shredded passing through the BCG core, leaving a nearly naked SMBH fleeing from the BCG with space velocity v≳2000 km s{sup −1}. The radio galaxy has mass M≲6×10{sup 9} M{sub ⊙} and infrared luminosity L{sub IR}∼3×10{sup 11} L{sub ⊙} close to its dust Eddington limit, so it is vulnerable to further mass loss from radiative feedback.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1966

Numerical Studies of the Non-linear Vlasov Equation

The subject of this dissertation is the numerical integration of the initial-value problem for the non-linear Vlasov equation. The Vlasov equation is used to describe the dynamics of a "collisionless", one-dimensional, classical electron gas confined between two perfectly reflecting boundaries. Only the long-range Coulomb interactions of the electrons are considered; effects associated with the discrete structure are neglected. The numerical results obtained for non-linear Landau damping compare well with similar results obtained by Knorr. A general statement of the results on stable initial conditions is: As the degree of non-linearity of the initial conditions is increased, the deviation from linear Landau damping appears sooner and is more severe. In some cases damping was observed to cease. Curves showing the time dependence of the damping decrement are derived and compared with predictions of non-linear theories. New results obtained in this study include the observation that for strongly non-linear cases, the damping of the electric field causes an initially Maxwellian fo (v, O) to develop a peak in the neighborhood of the phase velocity; strong growth of the second harmonic is seen after fo (v, t) develops such a peak. Also new in this study is the interpretation of the development of a certain class of strongly unstable initial conditions as approaching an inhomogeneous equilibrium.

NUMERICAL INTEGRATION↗
NASA NTRS1975

Interactive handling of TV and range data for remotely controlled systems

The sensory subsystem of the JPL robotics project is described. The first sensory instrument is a pair of TV cameras, which provides a stereo view of the area of interest. The second is a laser range finder, which can be aimed in a requested direction and measure distance to a surface point that reflects the beam back. Both instruments are controlled by and are interfaced to computer. The calibration process and basic applications to obtain measurements of the external environment are described.

Yakimovsky, Y.↗
NASA NTRS1978

Industrial ion source technology

An analytical model was developed to describe the development of a coned surface texture with ion bombardment and simultaneous deposition of an impurity. A mathematical model of sputter deposition rate from a beveled target was developed in conjuction with the texturing models to provide an important input to that model. The establishment of a general procedure that will allow the treatment of manay different sputtering configurations is outlined. Calculation of cross sections for energetic binary collisions was extened to Ar, Kr.. and Xe with total cross sections for viscosity and diffusion calculated for the interaction energy range from leV to 1000eV. Physical sputtering and reactive ion etching experiments provided experimental data on the operating limits of a broad beam ion source using CF4 as a working gas to produce reactive species in a sputtering beam. Magnetic clustering effects are observed when Al is seeded with Fe and sputtered with Ar(?) ions. Silicon was textured at a micron scale by using a substrate temperature of 600 C.

Kaufman, H. R.↗
NASA NTRS1986

The far-infrared and optical structure of Arp 220

The spatial structure of the luminous peculiar galaxy Arp 220 has been investigated in the far infrared. The results reveal that most of the luminosity is from a source less than 3 kpc in extent, located in the nuclear region of the galaxy. The size constraints yield a lower limit of 0.05 for the 100 micron optical depth, implying a hydrogen column density over 5 x 10 to the 22nd/sq cm. New optical images confirm that the double-lobed optical appearance results from strong absorption across the true nucleus. Arp 220 exhibits three primary features which provide strong evidence for an external source of energy: (1) a chaotic and highly asymmetric galactic halo; (2) a large internal velocity dispersion in CO and H I; and (3) extreme compression of gas and dust. These features are natural consequences of previously proposed models which invoke a direct galactic collision and merger, and are unlikely to result from a long-range tidal interaction with the neighboring galaxy IC 4554.

Joy, M.↗
NASA NTRS1988

Model-independent constraints on possible modifications of Newtonian gravity

New model-independent constraints on possible modifications of Newtonian gravity over solar-system distance scales are presented, and their implications discussed. The constraints arise from the analysis of various planetary astrometric data sets. The results of the model-independent analysis are then applied to set limits on a variation in the l/r-squared behavior of gravity, on possible Yukawa-type interactions with ranges of the order of planetary distance scales, and on a deviation from Newtonian gravity of the type discussed by Milgrom (1983).

Talmadge, C.↗
NASA NTRS1988

PC-CUBE: A Personal Computer Based Hypercube

PC-CUBE is an ensemble of IBM PCs or close compatibles connected in the hypercube topology with ordinary computer cables. Communication occurs at the rate of 115.2 K-band via the RS-232 serial links. Available for PC-CUBE is the Crystalline Operating System III (CrOS III), Mercury Operating System, CUBIX and PLOTIX which are parallel I/O and graphics libraries. A CrOS performance monitor was developed to facilitate the measurement of communication and computation time of a program and their effects on performance. Also available are CXLISP, a parallel version of the XLISP interpreter; GRAFIX, some graphics routines for the EGA and CGA; and a general execution profiler for determining execution time spent by program subroutines. PC-CUBE provides a programming environment similar to all hypercube systems running CrOS III, Mercury and CUBIX. In addition, every node (personal computer) has its own graphics display monitor and storage devices. These allow data to be displayed or stored at every processor, which has much instructional value and enables easier debugging of applications. Some application programs which are taken from the book Solving Problems on Concurrent Processors (Fox 88) were implemented with graphics enhancement on PC-CUBE. The applications range from solving the Mandelbrot set, Laplace equation, wave equation, long range force interaction, to WaTor, an ecological simulation.

Ho, Alex↗
NASA NTRS1990

First-principles calculations of shear moduli for Monte Carlo-simulated Coulomb solids

The paper presents a first-principles study of the shear modulus tensor for perfect and imperfect Coulomb solids. Allowance is made for the effects of thermal fluctuations for temperatures up to the melting conditions. The present theory treats the cases of the long-range Coulomb interaction, where volume fluctuations should be avoided in the Ewald sums.

Ogata, Shuji↗
NASA NTRS1992

Terraced spreading of simple liquids on solid surfaces

We have studied the spreading of liquid drops on a solid surface by molecular-dynamics simulations of coexisting three-phase Lennard-Jones systems of liquid, vapor, and solid. We consider both spherically symmetric atoms and diatomic molecules, and a range of interaction strengths. As the attraction between liquid and solid increases we observe a smooth transition in spreading regimes, from partial to complete to terraced wetting. In the terraced case, where distinct monomolecular layers spread with different velocities, the layers are ordered but not solid, with substantial molecular diffusion both within and between layers. The quantitative behavior resembles recent experimental findings, but the detailed dynamics differ. In particular, the layers exhibit an unusual spreading law, where their radii vary in time as R-squared approximately equal to log10t, which disagrees with experiments on polymeric liquids as well as recent calculations.

Yang, Ju-Xing↗
NASA NTRS1993

Degrees of locality of energy transfer in the inertial range

Measured raw transfer interactions from which local energy transfer is argued to result are summed in a way that directly indicates the scale disparity (s) of contributions to the net energy flux across the spectrum. It is found that the dependence upon s closely follows the s exp -4/3 form predicted by classical arguments. As a result, it is concluded that direct numerical simulation measurements lend support to the classical Kolmogorov phenomenology of local interactions and local transfer in an inertial range.

Zhou, YE↗
NASA NTRS1994

Wetting and spreading at the molecular scale

We have studied the microscopic aspects of the spreading of liquid drops on a solid surface by molecular dynamics simulations of coexisting three-phase Lennard-Jones systems of liquid, vapor and solid. We consider both spherically symmetric atoms and chain-like molecules, and a range of interaction strengths. As the attraction between liquid and solid increases we observed a smooth transition in spreading regimes, from partial to complete to terraced wetting. In the terraced case, where distinct monomolecular layers spread with different velocities, the layers are ordered but not solid, with qualitative behavior resembling recent experimental findings, but with interesting differences in the spreading rate.

Koplik, Joel↗
NASA NTRS1999

Phase Diagrams of Electric-Fduced Aggregation in Conducting Colloids

Under the application of a sufficiently strong electric field, a suspension may undergo reversible phase transitions from a homogeneous random arrangement of particles into a variety of ordered aggregation patterns. The surprising fact about electric-field driven phase transitions is that the aggregation patterns, that are observed in very diverse systems of colloids, display a number of common structural features and modes of evolution thereby implying that a universal mechanism may exist to account for these phenomena. It is now generally believed that this mechanism emanates from the presence of the long-range anisotropic interactions between colloidal particles due to their polarization in an applied field. But, in spite of numerous applications of the electric-field-driven phenomena in biotechnology, separation, materials engineering, chemical analysis, etc. our understanding of these phenomena is far from complete. Thus, it is the purpose of the proposed research to develop a theory and then test experimentally, under normal- and low-gravity conditions, the accuracy of the theoretical predictions regarding the effect of the synergism of the interparticle electric and hydrodynamic interactions on the phase diagram of a suspension. The main results from our theoretical studies performed to-date enable one to trace how the variations of the electrical properties of the constituent materials influence the topology of the suspension phase diagram and then, by using an appropriate phase diagram, to evaluate how the electric-field-induced transformations will depend on the frequency and the strength of the applied field.

Khusid, B.↗
NASA NTRS2000

Glass/Jamming Transition in Colloidal Aggregation

We have studied colloidal aggregation in a model colloid plus polymer system with short-range attractive interactions. By varying the colloid concentration and the strength of the attraction, we explored regions where the equilibrium phase is expected to consist of colloidal crystallites in coexistance with colloidal gas (i.e. monomers). This occurs for moderate values of the potential depth, U approximately equal to 2-5 kT. Crystallization was not always observed. Rather, over an extended sub-region two new metastable phases appear, one fluid-like and one solid-like. These were examined in detail with light scattering and microscopy techniques. Both phases consist of a near uniform distribution of small irregular shaped clusters of colloidal particles. The dynamical and structural characteristics of the ergodic-nonergodic transition between the two phases share much in common with the colloidal hard sphere glass transition.

Segre, Philip N.↗
NASA NTRS2001

Inertial Screening in Sedimentation

Using particle image velocimetry we have measured the sedimentation dynamics of non-Brownian spheres over a wide range of Reynolds numbers (Re) between 0.001 and 2.5. Particle velocity fluctuations about the mean settling velocity show large-scale correlations whose spatial extent and magnitude Delta V/V are independent of Re up to a critical value Re less than Re(sub c). For Re greater than Re(sub c) the fluctuations substantially diminish with increasing Reynolds number due to inertial screening of the long-range hydrodynamic interactions (HI). The onset of inertial affects is found to occur when the Oseen length l(sub o)=v/V becomes of order the correlation length. In the inertial regime, the velocity fluctuations follow -(Delta V/V)(sup 2) approaching ln(Re), in agreement with an integration of the (l/r) HI over a narrow region extending up to the Oseen length l(sub o). A simple "blob" model connects the measured correlation lengths to the magnitudes of the velocity fluctuations.

Segre, P. N.↗
NASA NTRS2005

An Advanced Orbiting Systems Approach to Quality of Service in Space-Based Intelligent Communication Networks

As humans and robotic technologies are deployed in future constellation systems, differing traffic services will arise, e.g., realtime and non-realtime. In order to provide a quality of service framework that would allow humans and robotic technologies to interoperate over a wide and dynamic range of interactions, a method of classifying data as realtime or non-realtime is needed. In our paper, we present an approach that leverages the Consultative Committee for Space Data Systems (CCSDS) Advanced Orbiting Systems (AOS) data link protocol. Specifically, we redefine the AOS Transfer Frame Replay Flag in order to provide an automated store-and-forward approach on a per-service basis for use in the next-generation Interplanetary Network. In addition to addressing the problem of intermittent connectivity and associated services, we propose a follow-on methodology for prioritizing data through further modification of the AOS Transfer Frame.

Riha, Andrew P.↗
NASA NTRS2006

Spin Changing Collisions of Hydrogen

We discuss spin changing collisions of hydrogen atoms. Employing a fully quantal theory we calculate and present new collision data. We discuss the respective roles of spin exchange and long range magnetic interactions in collisonal redistribution of sub-level populations. The calculated atomic data is needed for accurate modeling of 21 cm line emission/absorption by primordial hydrogen in the early universe.

Zygelman, Bernard↗