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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 451 records · Page 25
All sourcesNASA NTRSDOE OSTI
NASA NTRS1975

Vibration-translation energy transfer in anharmonic diatomic molecules. I - A comparative evaluation of the semiclassical approximation

The semiclassical approximation (quantum oscillator, classical path) is applied to anharmonic diatomic oscillators in excited initial states. Multistate numerical solutions giving the vibrational transition probabilities for collinear collisions with an inert atom are compared with equivalent, exact quantum-mechanical calculations. Several symmetrization methods are shown to correlate accurately the predictions of both theories for all initial states, transitions, and molecular types tested, but only if coupling of the oscillator motion and the classical trajectory of the incident particle is considered. In anharmonic heteronuclear molecules, the customary semiclassical method of computing the classical trajectory independently leads to transition probabilities with anomalous low-energy resonances. Proper accounting of the effects of oscillator compression and recoil on the incident particle trajectory removes the anomalies and restores the applicability of the semiclassical approximation.

Mckenzie, R. L.↗
NASA NTRS1988

Microscopic filamentation due to electrothermal instability and plasma heating in time-dependent solar transition layer

Nonlinear equilibrium states of a microscopic current filamentation (electrothermal instability) in the solar atmosphere are explored. This phenomenon occurs for transition zone ion temperature plasmas provided that the electron to ion temperature ratio exceeds 1. It is shown that when the onset condition for the electrothermal instability is satisfied, the instability drives a current filamentation to a nonlinear equilibrium state that has a spatially periodic electron temperature variation with wavelength.

Hinata, Satoshi↗
NASA NTRS2013

Spectroscopic Determination of Trace Contaminants in High-Purity Oxygen

Oxygen used for extravehicular activities (EVAs) must be free of contaminants because a difference in a few tenths of a percent of argon or nitrogen content can mean significant reduction in available EVA time. These inert gases build up in the extravehicular mobility unit because they are not metabolized or scrubbed from the atmosphere. A prototype optical emission technique capable of detecting argon and nitrogen below 0.1% in oxygen has been developed. This instrument uses a glow discharge in reduced-pressure gas to produce atomic emission from the species present. Because the atomic emission lines from oxygen, nitrogen, and argon are discrete, and in many cases well-separated, trace amounts of argon and nitrogen can be detected in the ultraviolet and visible spectrum. This is a straightforward, direct measurement of the target contaminants, and may lend itself to a device capable of on-orbit verification of oxygen purity. A glow discharge is a plasma formed in a low-pressure (1 to 10 Torr) gas cell between two electrodes. Depending on the configuration, voltages ranging from 200 V and above are required to sustain the discharge. In the discharge region, the gas is ionized and a certain population is in the excited state. Light is produced by the transitions from the excited states formed in the plasma to the ground state. The spectrum consists of discrete, narrow emission lines for the atomic species, and broader peaks that may appear as a manifold for molecular species such as O2 and N2, the wavelengths and intensities of which are a characteristic of each atom. The oxygen emission is dominated by two peaks at 777 and 844 nm.

Hornung, Steven↗
NASA NTRS1975

Formation of molecular lines in stellar atmospheres

Statistical equilibrium of electronic states of diatomic molecules in stellar atmospheres is examined. Atmospheres discussed are representative of the sun, Arcturus (K-giant) and Betelgeuse (M-supergiant). A comparison of the relative collisional and radiative contributions to the equilibrium of the ground electronic state shows that this state is collisionally controlled and that the line source function for vibration-rotation transitions within this state is equivalent to the Planck function. Examination of the equilibrium for excited electronic states demonstrates that the exchange between these states and the ground electronic state is most probably determined by radiative excitation. This result implies that scattering rather than pure absorption is the appropriate mechanism for the formation of lines belonging to these electronic transitions. The scattering hypothesis is given a preliminary check against solar observations. Areas for future investigations are outlined.

Hinkle, K. H.↗
NASA NTRS1981

Spectroscopy of quasibound states formed by molecular collisions in the presence of a laser

A theory is reported which describes spectroscopic transitions between quasibound states formed during molecular collisions in a laser field. A preliminary calculation suggests that the shapes of absorption lines are sensitive to the shapes of the potentials; hence a method for determining the latter. The calculation also shows that respectable cross-sections for scattering can be obtained at low laser powers.

Hutchinson, M.↗
NASA NTRS1979

An atomic model for neutral and singly ionized uranium

A model for the atomic levels above ground state in neutral, U(0), and singly ionized, U(+), uranium is described based on identified atomic transitions. Some 168 states in U(0) and 95 in U(+) are found. A total of 1581 atomic transitions are used to complete this process. Also discussed are the atomic inverse lifetimes and line widths for the radiative transitions as well as the electron collisional cross sections.

Maceda, E. L.↗
NASA NTRS1991

Correlation of normal and superconducting properties and unified approach to the description of high Tc oxides

We present a unified approach based on the Fermi liquid picture which allows us to describe the normal as well as the superconducting properties of the doped cuprates. The theory that is presented is for the doped compounds which are metallic. One can distinguish two interrelated, but nevertheless, different directions in the physics of high T(sub c): one involving the problem of carrier doping and the transition to the metallic state, and the second being the description of the metallic state. It is important that this metallic phase undergoes the transition into the superconducting state; as a result, our analysis is directly related to the origin of high T(sub c). We are using a quasi-2D Fermi liquid model to estimate the fundamental parameters of these very interesting materials. We find that this description is able to describe these materials and also that phonons and plasmons play a major role in the mechanism of high T(sub c).

Kresin, V. Z.↗
NASA NTRS1972

Study of excitation transfer in flowing helium afterglow pumped with a tuneable dye laser. 2: Measurement of the rate coefficient for the rotational relaxation of He2(3p (3 Pi g))

The rotational relaxation of the He2(3p(3pi g)) state is examined by optically pumping a flowing helium afterglow with a tuneable dye laser. The population of the J = 8 rotational state is enhanced by optically saturating the R sub 7 component of the transition connecting this state with the metastable He2(2s (3 Sigma u +)) molecular state. From the lifetime and yield of the Q sub 7 component, the rate coefficient for the rotational relaxation via the forbidden delta J = 1 channel is determined to be of the order of 2 x 10 to the minus 11th power cm3/sec. It is found that this represents about half of the total rate of rotational relaxation in this state.

Collins, C. B.↗
NASA NTRS1977

Glass transitions in lubricants - Its relation to elastohydrodynamic lubrication /EHD/

A preliminary investigation into the possible role of glass transition and glassy state behavior of lubricants in EHD contacts is reported. Measurements of the glass transition of lubricants as a function of pressure by two methods are presented along with a discussion indicating possible implications of the results to EHD lubrication.

Alsaad, M.↗
NASA NTRS2001

Better, Cheaper, Faster Molecular Dynamics

Recent, revolutionary progress in genomics and structural, molecular and cellular biology has created new opportunities for molecular-level computer simulations of biological systems by providing vast amounts of data that require interpretation. These opportunities are further enhanced by the increasing availability of massively parallel computers. For many problems, the method of choice is classical molecular dynamics (iterative solving of Newton's equations of motion). It focuses on two main objectives. One is to calculate the relative stability of different states of the system. A typical problem that has' such an objective is computer-aided drug design. Another common objective is to describe evolution of the system towards a low energy (possibly the global minimum energy), "native" state. Perhaps the best example of such a problem is protein folding. Both types of problems share the same difficulty. Often, different states of the system are separated by high energy barriers, which implies that transitions between these states are rare events. This, in turn, can greatly impede exploration of phase space. In some instances this can lead to "quasi non-ergodicity", whereby a part of phase space is inaccessible on time scales of the simulation. To overcome this difficulty and to extend molecular dynamics to "biological" time scales (millisecond or longer) new physical formulations and new algorithmic developments are required. To be efficient they should account for natural limitations of multi-processor computer architecture. I will present work along these lines done in my group. In particular, I will focus on a new approach to calculating the free energies (stability) of different states and to overcoming "the curse of rare events". I will also discuss algorithmic improvements to multiple time step methods and to the treatment of slowly decaying, log-ranged, electrostatic effects.

Pohorille, Andrew↗
NASA NTRS1987

Alpha-decay-induced fracturing in zircon - The transition from the crystalline to the metamict state

Zonation due to alpha-decay damage in a natural single crystal of zircon from Sri Lanka is discussed. The zones vary in thickness on a scale from one to hundreds of microns. The uranium and thorium concentrations vary from zone to zone such that the alpha decay dose is between 0.2 x 10 to the 16th and 0.8 x 10 to the 16th alpha-events per milligram. The transition from the crystalline to the aperiodic metamict state occurs over this dose range. At doses greater than 0.8 x 10 to the 16th alpha events/mg there is no evidence for long-range order. This type of damage will accumulate in actinide-bearing, ceramic nuclear waste forms. The systematic pattern of fractures would occur in crystalline phases that are zoned with respect to actinide radionuclides.

Chakoumakos, Bryan C.↗
NASA NTRS2010

Heat Entrapment Effects Within Liquid Acquisition Devices

We introduce a model problem to address heat entrapment effects or the local accumulation of thermal energy within liquid acquisition devices. We show that the parametric space consists of six parameters, namely the Rayleigh and Prandtl numbers, the aspect ratio, and heat flux ratios for the bottom, side, and top boundaries of the enclosure. For the range of Ra considered 1 to 10(sup 9), beyond Ra on the order of 10(sup 5), convective instability is the dominant mode of convection in comparison to natural convection. The flow field transitions to asymmetric modes at Ra on the order of 10(sup 7). Direct numerical simulation of a large geometric length scale prototype for Ra on the order of 10(sup 9) shows that the flow field evolves from small wavelength instability which gives rise to nonlinear growth of thermals, propagation of the instability occurs via growth of secondary and tertiary modes, and a travelling wave mode occurs prior to asymmetry. The effect of a large aspect ratio is to increase the number of modes in the vertical direction. Due to the slow diffusion of heat in the prototype, asymptotic states are not readily attained, we show that dynamical similarity can be used for a model which allows the attainment of asymptotic states and that transition to a chaotic state occurs for Ra on the order of 10(sup 9) via a broadband power spectrum. These dynamical events show that for the baseline condition in which heat is absorbed from background laboratory environment, higher heat flux is absorbed at the top and bottom boundaries of the enclosure than a nominal value of 34.9 ergs per square centimeter -second.

Duval, W. M. B.↗
NASA NTRS2017

NASA Soil Moisture Active Passive Mission Status and Science Highlights

The Soil Moisture Active Passive (SMAP) observatory was launched January 31, 2015, and its L-band radiometer and radar instruments became operational during April 2015. This paper provides a summary of the quality assessment of its baseline soil moisture and freeze/thaw products as well as an overview of new products. The first new product explores the Backus Gilbert optimum interpolation based on the oversampling characteristics of the SMAP radiometer. The second one investigates the disaggregation of the SMAP radiometer data using the European Space Agency's Sentinel-1 C-band synthetic aperture radar (SAR) data to obtain soil moisture products at about 1 to 3 km resolution. In addition, SMAPs L-band data have been found useful for many scientific applications, including depictions of water cycles, vegetation opacity, ocean surface salinity and hurricane ocean surface wind mapping. Highlights of these new applications will be provided.The SMAP soil moisture, freeze/taw state and SSSprovide a synergistic view of water cycle. For example, Fig.7 illustrates the transition of freeze/thaw state, change of soilmoisture near the pole and SSS in the Arctic Ocean fromApril to October in 2015 and 2016. In April, most parts ofAlaska, Canada, and Siberia remained frozen. Melt onsetstarted in May. Alaska, Canada, and a big part of Siberia havebecome thawed at the end of May; some freshwater dischargecould be found near the mouth of Mackenzie in 2016, but notin 2015. The soil moisture appeared to be higher in the Oband Yenisei river basins in Siberia in 2015. As a result,freshwater discharge was more widespread in the Kara Seanear the mouths of both rivers in June 2015 than in 2016. TheNorth America and Siberia have become completely thawedin July. After June, the freshwater discharge from other riversinto the Arctic, indicated by blue, also became visible. Thefreeze-up started in September and the high latitude regionsin North America and Eurasia became frozen. Comparing thespread of freshwater in August 2015 and 2016 suggests thatthere was more discharge from Ob and Yenisei in 2015,which appeared to correspond to a higher soil moisturecontent in the Ob and Yenisei basins. In contrast, Mackenzieappeared to have more discharge in September 2016.

soil moisture↗
NASA NTRS1985

The detection of acetaldehyde in cold dust clouds

Observations of the 1(01)-0(00) rotational transitions of A and E state acetaldehyde are reported. The transitions were detected, for the first time in interstellar space, in the cold dust clouds TMC-1 and L134N, and in Sgr B2. This is also the first time acetaldehyde has been found in a dust cloud and is the most complex oxygen-bearing molecule yet known in this environment. A column density of 6 x 10 to the 12th/sq cm in TMC-1, comparable to many other species detected there, and an approximately equal column density in L134N are formed. In the direction of Sgr B2, the CH3CHO profile appears to consist of broad emission features from the hot molecular cloud core, together with absorption features resulting from intervening colder material. The possible detection of HC9N toward IRC + 10 deg 216 through its J = 33-32 transition is also reported. Implications for cold dust cloud chemistry and excitation are discussed.

Matthews, H. E.↗
NASA NTRS2005

Atomic Clock Based on Opto-Electronic Oscillator

A proposed highly accurate clock or oscillator would be based on the concept of an opto-electronic oscillator (OEO) stabilized to an atomic transition. Opto-electronic oscillators, which have been described in a number of prior NASA Tech Briefs articles, generate signals at frequencies in the gigahertz range characterized by high spectral purity but not by longterm stability or accuracy. On the other hand, the signals generated by previously developed atomic clocks are characterized by long-term stability and accuracy but not by spectral purity. The proposed atomic clock would provide high spectral purity plus long-term stability and accuracy a combination of characteristics needed to realize advanced developments in communications and navigation. In addition, it should be possible to miniaturize the proposed atomic clock. When a laser beam is modulated by a microwave signal and applied to a photodetector, the electrical output of the photodetector includes a component at the microwave frequency. In atomic clocks of a type known as Raman clocks or coherent-population-trapping (CPT) clocks, microwave outputs are obtained from laser beams modulated, in each case, to create two sidebands that differ in frequency by the amount of a hyperfine transition in the ground state of atoms of an element in vapor form in a cell. The combination of these sidebands produces a transparency in the population of a higher electronic level that can be reached from either of the two ground-state hyperfine levels by absorption of a photon. The beam is transmitted through the vapor to a photodetector. The components of light scattered or transmitted by the atoms in the two hyperfine levels mix in the photodetector and thereby give rise to a signal at the hyperfine- transition frequency. The proposed atomic clock would include an OEO and a rubidium- or cesium- vapor cell operating in the CPT/Raman regime (see figure). In the OEO portion of this atomic clock, as in a typical prior OEO, a laser beam would pass through an electro-optical modulator, the modulated beam would be fed into a fiber-optic delay line, and the delayed beam would be fed to a photodetector. The electrical output of the photodetector would be detected, amplified, filtered, and fed back to the microwave input port of the modulator. The laser would be chosen to have the same wavelength as that of the pertinent ground-state/higher-state transition of the atoms in the vapor. The modulator/ filter combination would be designed to operate at the microwave frequency of the hyperfine transition. Part of the laser beam would be tapped from the fiberoptic loop of the OEO and introduced into the vapor cell. After passing through the cell, this portion of the beam would be detected differentially with a tapped portion of the fiber-optically-delayed beam. The electrical output of the photodetector would be amplified and filtered in a loop that would control a DC bias applied to the modulator. In this manner, the long-term stability and accuracy of the atomic transition would be transferred to the OEO.

Maleki, Lute↗
NASA NTRS1974

Radiative transitions involving the /2p2/ 3Pe metastable autodetaching state of H-

A Hylleraas bound-state wave function and 1s-2s-2p close-coupling continuum wave functions are used to calculate the absorption coefficient for the free-bound transition of H(1s) + e + quantum to a H anion in (2p2,3Pe) and the differential emission rate for the inverse process. The absorption and emission spectral maximum is found to be at a photon wavelength of 1219.5 A, an improvement of 2 A on other calculations. This free-bound absorption process appears to be a significant source of continuous ultraviolet opacity.

Jacobs, V. L.↗