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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 325 records · Page 18
All sourcesNASA NTRSDOE OSTI
NASA NTRS1976

Computer simulation of concentrated solid solution strengthening

The interaction forces between a straight edge dislocation moving through a three-dimensional block containing a random array of solute atoms were determined. The yield stress at 0 K was obtained by determining the average maximum solute-dislocation interaction force that is encountered by edge dislocation, and an expression relating the yield stress to the length of the dislocation and the solute concentration is provided. The magnitude of the solid solution strengthening due to solute atoms can be determined directly from the numerical results, provided the dislocation line length that moves as a unit is specified.

Kuo, C. T. K.↗
NASA NTRS1995

Investigation of the collision line broadening problem as applicable to the NASA Optical Plume Anomaly Detection (OPAD) system, phase 1

As a final report for phase 1 of the project, the researchers are submitting to the Tennessee Tech Office of Research the following two papers (reprinted in this report): 'Collision Line Broadening Effects on Spectrometric Data from the Optical Plume Anomaly System (OPAD),' presented at the 30th AIAA/ASME/SAE/ASEE Joint Propulsion Conference, 27-29 June 1994, and 'Calculation of Collision Cross Sections for Atomic Line Broadening in the Plume of the Space Shuttle Main Engine (SSME),' presented at the IEEE Southeastcon '95, 26-29 March 1995. These papers fully state the problem and the progress made up to the end of NASA Fiscal Year 1994. The NASA OPAD system was devised to predict concentrations of anomalous species in the plume of the Space Shuttle Main Engine (SSME) through analysis of spectrometric data. The self absorption of the radiation of these plume anomalies is highly dependent on the line shape of the atomic transition of interest. The Collision Line Broadening paper discusses the methods used to predict line shapes of atomic transitions in the environment of a rocket plume. The Voigt profile is used as the line shape factor since both Doppler and collisional line broadening are significant. Methods used to determine the collisional cross sections are discussed and the results are given and compared with experimental data. These collisional cross sections are then incorporated into the current self absorbing radiative model and the predicted spectrum is compared to actual spectral data collected from the Stennis Space Center Diagnostic Test Facility rocket engine. The second paper included in this report investigates an analytical method for determining the cross sections for collision line broadening by molecular perturbers, using effective central force interaction potentials. These cross sections are determined for several atomic species with H2, one of the principal constituents of the SSME plume environment, and compared with experimental data.

Dean, Timothy C.↗
NASA NTRS1988

Fluid spray simulation with two-fluid nozzles

Two-phase interacting flow inside a two-fluid fuel atomizer was investigated and a correction of aerodynamic and liquid-surface forces with characteristic drop diameter was obtained for liquid-jet breakup in Mach 1 gas flow. Nitrogen gas mass-flux was varied from 6 to 50 g/sq cm sec by using four differently sized two-fluid atomizers with nozzle diameters varyig from 0.32 to 0.56 cm. The correlation was derived by using the acoustic gas velocity, V sub c, as a basic parameter in defining and evaluating the dimensionless product of the Weber (We) and Reynolds (Re) numbers. By using the definition of WeRe, it was found that the ratio of orifice diameter to Sauter mean drop diameter could be correlated with the dimensionless ratio WeRe and the gas to liquid density ratio.

Ingebo, Robert D.↗
NASA NTRS1989

Fuel spray simulation with two-fluid nozzles

Two-phase interacting flow inside a two-fluid fuel atomizer was investigated and a correction of aerodynamic and liquid-surface forces with characteristic drop diameter was obtained for liquid-jet breakup in Mach 1 gas flow. Nitrogen gas mass-flux was varied from 6 to 50 g/sq cm sec by using four differently sized two-fluid atomizers with nozzle diameters varying from 0.32 to 0.56 cm. The correlation was derived by using the acoustic gas velocity, V sub c, as a basic parameter in defining and evaluating the dimensionless product of the Weber (We) and Reynolds (Re) numbers. By using the definition of WeRe, it was found that the ratio of orifice diameter to Sauter mean drop diameter could be correlated with the dimensionless ratio WeRe and the gas to liquid density ratio.

Ingebo, Robert D.↗
NASA NTRS1995

SVN 9 End-Of-Life testing

SVN 9 was a GPS Block I research and development satellite. When it was launched in Jun. 1984, questions regarding the future performance of atomic frequency standards in orbit remained to be answered. In Mar. 1994, after performing for twice its designed life span, SVN 9 was deactivated as a member of the operational GPS satellite constellation. During the next two months, U.S. Air Force and Rockwell personnel performed various tests to determine just how well the atomic frequency standards had withstood ten years in the space environment. The results of these tests are encouraging. With a full constellation of Block II/IIA satellites on orbit, as well as the anticipated launch of the Block IIR satellites, results from the end of life testing will be helpful in assuring the continued success of the GPS program.

Hatten, Gregory E.↗
NASA NTRS1992

Theory of hydrophobicity: transient cavities in molecular liquids

Observation of the size distribution of transient cavities in computer simulations of water, n-hexane, and n-dodecane under benchtop conditions shows that the sizes of cavities are more sharply defined in liquid water but the most-probable-size cavities are about the same size in each of these liquids. The calculated solvent atomic density in contact with these cavities shows that water applies more force per unit area of cavity surface than do the hydrocarbon liquids. This contact density, or "squeezing" force, reaches a maximum near cavity diameters of 2.4 angstroms. The results for liquid water are compared to the predictions of simple theories and, in addition, to results for a reference simple liquid. The numerical data for water at a range of temperatures are analyzed to extract a surface free energy contribution to the work of formation of atomic-size cavities. Comparison with the liquid-vapor interfacial tensions of the model liquids studied here indicates that the surface free energies extracted for atomic-size cavities cannot be accurately identified with the macroscopic surface tensions of the systems.

NASA Center ARC↗
NASA NTRS1987

Collisional excitation of interstellar cyclopropenylidene

Theoretical rotational excitation rates were computed for C3H2 in collisions with He atoms at temperatures from 30 to 120 K. The intermolecular forces were obtained from accurate self-consistent field and perturbation theory calculations, and collision dynamics were treated within the infinite-order sudden approximation. The accuracy of the latter was examined by comparing with the more exact coupled states approximation.

Green, Sheldon↗
NASA NTRS1993

The nature of the hydrogen tori of Titan and Triton

The nature of the hydrogen tori of Titan and Triton is examined. Critical time scales of the two tori are discussed. For the Titan torus, where atom-atom collisions are not important, the time scale for solar radiation pressure to act on the system is shown to be comparable to the hydrogen lifetime due to ionization and charge exchange losses by solar, magnetospheric, and solar wind processes. The solar radiation pressure then provides a mechanism which destroys the initial azimuthal symmetry of the hydrogen atom orbits about the planet and causes atom orbits to move inward and to collide with the planet on its dusk side. For Triton, the atom-atom collision time scale dominates all other time scales in the system. The evolution of the torus is then an inherently nonlinear problem that depends upon the collisional redistribution of atom-orbit velocities in the presence of a planetary gravitational force field. This nonlinear process introduces an expansion mechanism into the torus problem which dramatically alters its structure.

Smyth, William H.↗
NASA NTRS1985

Shock tube study of the fuel structure effects on the chemical kinetic mechanisms responsible for soot formation, part 2

Soot formation in oxidation of allene, 1,3-butadiene, vinylacetylene and chlorobenzene and in pyrolysis of ethylene, vinylacetylene, 1-butene, chlorobenzene, acetylen-hydrogen, benzene-acetylene, benzene-butadiene and chlorobenzene-acetylene argon-diluted mixtures was studied behind reflected shock waves. The results are rationalized within the framework of the conceptual models. It is shown that vinylacetylene is much less sooty than allene, which indicates that conjugation by itself is not a sufficient factor for determining the sooting tendency of a molecule. Structural reactivity in the context of the chemical kinetics is the dominant factor in soot formation. Detailed chemical kinetic modeling of soot formation in pyrolysis of acetylene is reported. The main mass growth was found to proceed through a single dominant route composed of conventional radical reactions. The practically irreversible formation reactions of the fused polycyclic aromatics and the overshoot by hydrogen atom over its equilibrium concentration are the g-driving kinetic forces for soot formation.

Frenklach, M.↗
NASA NTRS2001

Electronic Transport Through Carbon Nanotubes: Effects of Structural Deformation and the Tube Chirality

Atomistic simulations using a combination of classical force field and Density-Functional-Theory (DFT) show that carbon atoms remain essentially sp2 coordinated in either bent tubes or tubes pushed by an atomically sharp AFM tip. Subsequent Green's-function-based transport calculations reveal that for armchair tubes there is no significant drop in conductance, while for zigzag tubes the conductance can drop by several orders of magnitude in AFM-pushed tubes. The effect can be attributed to simple stretching of the tube under tip deformation, which opens up an energy gap at the Fermi surface.

Maiti, Amitesh↗
NASA NTRS2003

Interfacial Reaction Studies Using ONIOM

In this report, we focus on the calculations of the energetics and chemical kinetics of heterogeneous reactions for Organometallic vapor phase epitaxy (OMVPE). The work described in this report builds upon our own previous thermochemical and chemical kinetics studies. The first of these articles refers to the prediction of thermochemical properties, and the latter one deals with the prediction of rate constants for gaseous homolytic dissociation reactions. The calculations of this investigation are at the microscopic level. The systems chosen consisted of a gallium nitride (GaN) substrate, and molecular nitrogen (N2) and ammonia (NH3) as adsorbants. The energetics for the adsorption and the adsorbant dissociation processes were estimated, and reaction rate constants for the dissociation reactions of free and adsorbed molecules were predicted. The energetics for substrate decomposition was also computed. The ONIOM method, implemented in the Gaussian98 program, was used to perform the calculations. This approach has been selected since it allows dividing the system into two layers that can be treated at different levels of accuracy. The atoms of the substrate were modeled using molecular mechanics6 with universal force fields, whereas the adsorbed molecules were approximated using quantum mechanics, based on density functional theory methods with B3LYP functionals and 6-311G(d,p) basis sets. Calculations for the substrate were performed in slabs of several unit cells in each direction. The N2 and NH3 adsorbates were attached to a central location at the Ga-lined surface.

Cardelino, Beatriz H.↗
NASA NTRS2003

Proceedings of the 2003 NASA/JPL Workshop on Fundamental Physics in Space

The 2003 Fundamental Physics workshop included presentations ranging from forces acting on RNA to properties of clouds of degenerate Fermi atoms, to techniques to probe for a added space-time dimensions, and to flight hardware for low temperature experiments, amongst others. Mark Lee from NASA Headquarters described the new strategic plan that NASA has developed under Administrator Sean O'Keefe's leadership. Mark explained that the Fundamental Physics community now needs to align its research program and the roadmap describing the long-term goals of the program with the NASA plan. Ulf Israelsson of JPL discussed how the rewrite of the roadmap will be implemented under the leadership of the Fundamental Physics Discipline Working Group (DWG). Nick Bigelow, chair of the DWG, outlined how investigators can contribute to the writing of the roadmap. Results of measurements on very cold clouds of Fermi atoms near a Feshbach resonance were described by three investigators. Also, new measurements relating to tests of Einstein equivalence were discussed. Investigators also described methods to test other aspects of Einstein's relativity theories.

Strayer, Don↗
NASA NTRS1990

Dropsize correlation for cryogenic liquid-jet atomization

Momentum transfer from high velocity nitrogen gas flow to liquid-nitrogen jets was investigated. A correlation of aerodynamic and liquid-surface forces with characteristic drop diameter was obtained for cryogenic liquid-jet breakup in Mach 1 gas flow. Nitrogen gas mass-flux was varied by using three differently sized two-fluid fuel atomizers with different nozzle diameters.

Ingebo, Robert D.↗
NASA NTRS1991

Dropsize correlation for cryogenic liquid-jet atomization

Momentum transfer from high velocity nitrogen gas flow to liquid-nitrogen jets was investigated. A correlation of aerodynamic and liquid-surface forces with characteristic drop diameter was obtained for cryogenic liquid-jet breakup in Mach 1 gas flow. Nitrogen gas mass-flux was varied by using three differently sized two-fluid fuel atomizers with different nozzle diameters.

Ingebo, Robert D.↗
NASA NTRS2003

Evaporative Cooling in a Holographic Atom Trap

We present progress on evaporative cooling of Rb-87 atoms in our Holographic Atom Trap (HAT). The HAT is formed by the interference of five intersecting YAG laser beams: atoms are loaded from a vapor-cell MOT into the bright fringes of the interference pattern through the dipole force. The interference pattern is composed of Talbot fringes along the direction of propagation of the YAG beams, prior to evaporative cooling each Talbot fringe contains 300,000 atoms at 50 micro-K and peak densities of 2 x 10(exp 14)/cu cm. Evaporative cooling is achieved through adiabatically decreasing the intensity of the YAG laser. We present data and calculations covering a range of HAT geometries and cooling procedures.

Newell, Raymond↗
NASA NTRS1973

Strength of Chemical Bonds

Students are not generally made aware of the extraordinary magnitude of the strengths of chemical bonds in terms of the forces required to pull them apart. Molecular bonds are usually considered in terms of the energies required to break them, and we are not astonished at the values encountered. For example, the Cl2 bond energy, 57.00 kcal/mole, amounts to only 9.46 x 10(sup -20) cal/molecule, a very small amount of energy, indeed, and impossible to measure directly. However, the forces involved in realizing the energy when breaking the bond operate over a very small distance, only 2.94 A, and, thus, f(sub ave) approx. equals De/(r - r(sub e)) must be very large. The forces involved in dissociating the molecule are discussed in the following. In consideration of average forces, the molecule shall be assumed arbitrarily to be dissociated when the atoms are far enough separated so that the potential, relative to that of the infinitely separated atoms, is reduced by 99.5% from the potential of the molecule at the equilibrium bond length (r(sub e)) for Cl2 of 1.988 A this occurs at 4.928 A.

Christian, Jerry D.↗
NASA NTRS1993

Solar-Driven Neutral Density Waves

Interstellar neutral hydrogen atoms flowing into the solar system are attracted by the solar gravitational force, repelled by solar hydrogen Ly-alpha radiation pressure, and are ionized, primarily, through charge exchange with the solar wind protons. The solar cycle variation of the radiation pressure causes the net central solar force to fluctuate between attraction and repulsion resulting in the modulation of the neutral hydrogen density about the usual time independent model. The calculation presented here shows that the time dependent downstream density is strongly modulated by a large number of travelling neutral density waves. The waves possess a continuous range of wavelengths as is to be expected for a Maxwellian gas subjected to several eleven year cycle variations during its journey through the solar system. The amplitudes of the density modulation were found to be quite large. The backscattered glow was found to depend on the position of the detector and the phase of the solar cycle. At the most favorable condition a deviation of the order of 25% from the time dependent glow might be observed.

Blum, P.↗