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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 901 records · Page 50

Dilaton field minimally coupled to 2+1 gravity; uniqueness of the static Chan-Mann black hole and new dilaton stationary metrics

Using the Schwarzschild coordinate frame for a static cyclic symmetric metric in 2+1 gravity coupled minimally to a dilaton logarithmically depending on the radial coordinate in the presence of an exponential potential, by solving first order linear Einstein equations, the general solution is derived and it is identified with the Chan–Mann dilaton solution. In these coordinates, a new stationary dilaton solution is obtained; it does not allow for a de Sitter–Anti-de Sitter limit at spatial infinity, where its structural functions increase indefinitely. On the other hand, it is horizonless and allows for a naked singularity at the origin of coordinates; moreover, one can identify at a large radial coordinate a (quasi-local) mass parameter and in the whole space a constant angular momentum. Via a general SL(2,R)–transformation, applied on the static cyclic symmetric metric, a family of stationary dilaton solutions has been generated. A particular SL(2,R)–transformation is identified, which gives rise to the rotating Chan–Mann dilaton solution. All the exhibited solutions have been characterized by their quasi-local energy, mass, and momentum through their series expansions at spatial infinity. The algebraic structure of the Ricci–energy-momentum, and Cotton tensors is given explicitly.

79 ASTRONOMY AND ASTROPHYSICS↗

Temperature dependence of the transverse piezoelectric coefficient of thin films and aging effects

We present a technique to measure the temperature dependence of the transverse piezoelectric coefficient e{sub 31,f} of thin films of lead zirconate titanate (PZT), aluminum nitride, and BaTiO{sub 3} deposited on Si wafers. It is based on the collection of electric charges induced by the deflection of a Si cantilever coated with the piezoelectric film. The aim of this work is to assess the role of temperature in the decay of the remnant polarization of these materials, in particular, in optimized gradient-free PZT with composition PbZr{sub 0.52}Ti{sub 0.48}O{sub 3}. It is found that in contrast to theoretical predictions, e{sub 31,f} decreases with temperature because of the dominance of relaxation effects. The observation of steps in the logarithmic aging decay law is reminiscent of memory effects seen in frustrated spin glasses.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Dependence of Kambersky damping on Fermi level and spin orientation

Kambersky damping represents the loss of magnetic energy from the electrons to the lattice through the spin orbit interaction. It is demonstrated that, for bcc Fe-based transition metal alloys, the logarithm of the energy loss is proportional to the density of states at the Fermi level. Both inter and intraband damping are calculated for spins at arbitrary angle to the previously examined [001] direction. Although the easy axis 〈100〉 shows isotropic relaxation and achieves the minimum damping value of 0.002, other directions, such as 〈110〉, show substantial anisotropic damping.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Dynamics of asymmetric binary glass formers. II. Results from nuclear magnetic resonance spectroscopy

Various {sup 2}H and {sup 31}P nuclear magnetic resonance (NMR) spectroscopy techniques are applied to probe the component dynamics of the binary glass former tripropyl phosphate (TPP)/polystyrene-d{sub 3} (PS) over the full concentration range. The results are quantitatively compared to those of a dielectric spectroscopy (DS) study on the same system previously published [R. Kahlau, D. Bock, B. Schmidtke, and E. A. Rössler, J. Chem. Phys. 140, 044509 (2014)]. While the PS dynamics does not significantly change in the mixtures compared to that of neat PS, two fractions of TPP molecules are identified, one joining the glass transition of PS in the mixture (α{sub 1}-process), the second reorienting isotropically (α{sub 2}-process) even in the rigid matrix of PS, although at low concentration resembling a secondary process regarding its manifestation in the DS spectra. Pronounced dynamical heterogeneities are found for the TPP α{sub 2}-process, showing up in extremely stretched, quasi-logarithmic stimulated echo decays. While the time window of NMR is insufficient for recording the full correlation functions, DS results, covering a larger dynamical range, provide a satisfactory interpolation of the NMR data. Two-dimensional {sup 31}P NMR spectra prove exchange within the broadly distributed α{sub 2}-process. As demonstrated by {sup 2}H NMR, the PS matrix reflects the faster α{sub 2}-process of TPP by performing a spatially highly hindered motion on the same timescale.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

On the non-stiffness of edge transport in L-mode tokamak plasmas

Transport analyses using first-principle turbulence codes and 11/2 -D transport codes usually study radial transport properties between the tokamak plasma magnetic axis and a normalized minor radius around 0.8. In this region, heat transport shows significantly stiff properties resulting in temperature scalelength values (R∕L{sub T}) that are relatively independent of the level of the radial heat flux. We have studied experimentally in the tokamak à configuration variable [F. Hofmann et al., Plasma Phys. Controlled Fusion 36, B277 (1994)] the radial electron transport properties of the edge region, close to the last closed flux surface, namely, between ρ{sub V}=√(V/V{sub edge})=0.8 to 1. It is shown that electron transport is not stiff in this region and high R∕L{sub Te} values (∼20–40) can be attained even for L-mode confinement. We can define a “pedestal” location, already in L-mode regimes, where the transport characteristics change from constant logarithmic gradient, inside ρ{sub V} = 0.8, to constant gradient between 0.8 and 1.0. In particular, we demonstrate, with well resolved T{sub e} and n{sub e} profiles, that the confinement improvement with plasma current I{sub p}, with or without auxiliary heating, is due to this non-stiff edge region. This new result is used to explain the significant confinement improvement observed with negative triangularity, which could not be explained by theory to date. Preliminary local gyrokinetic simulations are now consistent with an edge, less stiff, region that is more sensitive to triangularity than further inside. We also show that increasing the electron cyclotron heating power increases the edge temperature inverse scalelength, in contrast to the value in the main plasma region. The dependence of confinement on density in ohmic plasmas is also studied and brings new insight in the understanding of the transition between linear and saturated confinement regimes, as well as of the density limit and appearance of a 2/1 tearing mode. The results presented in this paper provide an important new perspective with regards to radial transport in tokamak plasmas which goes beyond L-mode plasmas and explains some previous puzzling results. It is proposed that understanding the transport properties in this edge non-stiff region will also help in understanding the improved and high confinement edge properties.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Charge transport in colloidal ZnO nanocrystal solids: The significance of surface states

We investigate charge transport behaviour in colloidal ZnO nanocrystal solids with different surface states. Our results show that the logarithm of the conductivity scales with −T{sup −1/4}, suggestive of Mott variable-range hopping. Analysis of the density of states at the Femi level suggests that the charge hopping occurs through surface or defect states, rather than by direct hopping between quantum-confined conduction band states of the nanocrystals.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

The charge conserving Poisson-Boltzmann equations: Existence, uniqueness, and maximum principle

The present article is concerned with the charge conserving Poisson-Boltzmann (CCPB) equation in high-dimensional bounded smooth domains. The CCPB equation is a Poisson-Boltzmann type of equation with nonlocal coefficients. First, under the Robin boundary condition, we get the existence of weak solutions to this equation. The main approach is variational, based on minimization of a logarithm-type energy functional. To deal with the regularity of weak solutions, we establish a maximum modulus estimate for the standard Poisson-Boltzmann (PB) equation to show that weak solutions of the CCPB equation are essentially bounded. Then the classical solutions follow from the elliptic regularity theorem. Second, a maximum principle for the CCPB equation is established. In particular, we show that in the case of global electroneutrality, the solution achieves both its maximum and minimum values at the boundary. However, in the case of global non-electroneutrality, the solution may attain its maximum value at an interior point. In addition, under certain conditions on the boundary, we show that the global non-electroneutrality implies pointwise non-electroneutrality.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Dislocation-related trap levels in nitride-based light emitting diodes

Deep level transient spectroscopy was performed on InGaN/GaN multiple quantum well light emitting diodes (LEDs) in order to determine the effect of the dislocation density on the deep intragap electronic levels. The LEDs were grown by metalorganic vapor phase epitaxy on GaN templates with a high dislocation density of 8 × 10{sup 9} cm{sup −2} and a low dislocation density of 3 × 10{sup 8} cm{sup −2}. Three trapping levels for electrons were revealed, named A, A1, and B, with energies E{sub A} ≈ 0.04 eV, E{sub A1} ≈ 0.13 eV, and E{sub B} ≈ 0.54 eV, respectively. The trapping level A has a much higher concentration in the LEDs grown on the template with a high density of dislocations. The logarithmic dependence of the peak amplitude on the bias pulse width for traps A and A1 identifies the defects responsible for these traps as associated with linearly arranged defects. We conclude that traps A and A1 are dislocation-related intragap energy levels.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Interface-dependent magnetotransport properties for thin Pt films on ferrimagnetic Y{sub 3}Fe{sub 5}O{sub 12}

We have studied magnetoresistance and Hall effects for 1.8-nm-thick Pt films grown on a ferrimagnetic insulator Y{sub 3}Fe{sub 5}O{sub 12} in a wide temperature (0.46–300 K) and magnetic-field (−15 to 15 T) region. In the low-temperature regime where quantum corrections to conductivity are observed, weak antilocalization behavior observed in Pt films is critically suppressed when the film is attached to Y{sub 3}Fe{sub 5}O{sub 12}. Hall resistance in the Pt film is also affected by Y{sub 3}Fe{sub 5}O{sub 12}, and it exhibits logarithmic temperature dependence in a broad temperature range. The magnetotransport properties in the high-field range are significantly influenced by the interface between Pt and Y{sub 3}Fe{sub 5}O{sub 12}.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

On transition from Alfvén resonance to forced magnetic reconnection

We revisit the transition from Alfvén resonance to forced magnetic reconnection with a focus on the property of their singularities. As the driven frequency tends to zero, the logarithmic singularity of Alfvén resonance shifts to the power-law singularity of forced reconnection, due to merging of the two resonance layers. The transition criterion depends on either kinetic effects or dissipations that resolve the singularity. As an example, a small but finite resistivity η is introduced to investigate the transition process. The transition threshold is then obtained as the driven frequency reaches a level of ∼O((η/k){sup 1/3})

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

A feedback control strategy for the airfoil system under non-Gaussian colored noise excitation

The stability of a binary airfoil with feedback control under stochastic disturbances, a non-Gaussian colored noise, is studied in this paper. First, based on some approximated theories and methods the non-Gaussian colored noise is simplified to an Ornstein-Uhlenbeck process. Furthermore, via the stochastic averaging method and the logarithmic polar transformation, one dimensional diffusion process can be obtained. At last by applying the boundary conditions, the largest Lyapunov exponent which can determine the almost-sure stability of the system and the effective region of control parameters is calculated.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Solute-solvent cavity and bridge functions. I. Varying size of the solute

In this work we present the results of the extensive molecular simulations of solute-solvent cavity and bridge functions. The mixtures of Lennard-Jones solvent with Lennard-Jones solute at infinite dilution are considered for different solute-solvent size ratios—up to 4:1. The Percus-Yevick and hypernetted chain closures deviate substantially from simulation results in the investigated temperature and density ranges. We also find that the behavior of the indirect and cavity correlation functions is non-monotonous within the hard-core region, but the latter can be successfully approximated by mean-field theory if the solute-solvent interaction energy is divided into repulsive and attractive contribution, according to Weeks-Chandler-Andersen theory. Furthermore, in spite of the non-monotonous behavior of logarithm of the cavity function and the indirect correlation function, their difference, i.e., the bridge function remains constant within the hard-core region. Such behavior of the bridge and indirect correlation functions at small distances and for small values of indirect correlation function is well known from the Duh-Haymet plots, where the non-unique relationship results in loops of the bridge function vs. indirect correlation function graphs. We show that the same pathological behavior appears also when distance is small and indirect correlation function is large. We further show that the unique functional behavior of the bridge function can be established when bridge is represented as a function of the renormalized, repulsive indirect correlation function.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Vibrationally specific photoionization cross sections of acrolein leading to the Χ{sup ~}A{sup '} ionic state

The vibrational branching ratios in the photoionization of acrolein for ionization leading to the Χ{sup ~}A{sup '} ion state were studied. Computed logarithmic derivatives of the cross section and the corresponding experimental data derived from measured vibrational branching ratios for several normal modes (ν{sub 9}, ν{sub 10}, ν{sub 11}, and ν{sub 12}) were found to be in relatively good agreement, particularly for the lower half of the 11–100 eV photon energy range considered. Two shape resonances have been found near photon energies of 15.5 and 23 eV in the photoionization cross section and have been demonstrated to originate from the partial cross section of the A{sup ′} scattering symmetry. The wave functions computed at the resonance complex energies are delocalized over the whole molecule. By looking at the dependence of the cross section on the different normal mode displacements together with the wave function at the resonant energy, a qualitative explanation is given for the change of the cross sections with respect to changing geometry.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Premelting, fluctuations, and coarse-graining of water-ice interfaces

Using statistical field theory supplemented with molecular dynamics simulations, we consider premelting on the surface of ice as a generic consequence of broken hydrogen bonds at the boundary between the condensed and gaseous phases. A procedure for coarse-graining molecular configurations onto a continuous scalar order parameter field is discussed, which provides a convenient representation of the interface between locally crystal-like and locally liquid-like regions. A number of interfacial properties are straightforwardly evaluated using this procedure such as the average premelting thickness and surface tension. The temperature and system size dependence of the premelting layer thickness calculated in this way confirms the characteristic logarithmic growth expected for the scalar field theory that the system is mapped onto through coarse-graining, though remains finite due to long-ranged interactions. Finally, from explicit simulations the existence of a premelting layer is shown to be insensitive to bulk lattice geometry, exposed crystal face, and curvature.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Electronic structure evolution in doping of fullerene (C{sub 60}) by molybdenum trioxide

Molybdenum oxide doping of fullerene has been investigated using ultraviolet photoemission spectroscopy (UPS), X-ray photoemission spectroscopy (XPS), and inverse photoemission spectroscopy (IPES). The lowest unoccupied molecular orbital and the highest occupied molecular orbital (HOMO) can be observed directly with IPES and UPS. It is observed that the Fermi level position in fullerene is modified by molybdenum oxide doping, and the HOMO onset is shifted to less than 0.3 eV below the Fermi level. The energy level shift is found to saturate at doping ratio of 18%. Till this stage, the shift depends on the doping concentration in a semi-logarithmic scale, with a slope substantially higher than that of the traditional semiconductor theory. The XPS results indicate that charge transfer continues beyond the energy level shift saturation till the doping ratio reaches 66% as evidenced by the Mo{sup 5+} component. At higher doping concentration, there is more Mo{sup 6+} component, which indicates the saturation of the charge transfer between MoO{sub x} and C{sub 60}.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Ion temperature gradient driven turbulence with strong trapped ion resonance

A theory to describe basic characterization of ion temperature gradient driven turbulence with strong trapped ion resonance is presented. The role of trapped ion granulations, clusters of trapped ions correlated by precession resonance, is the focus. Microscopically, the presence of trapped ion granulations leads to a sharp (logarithmic) divergence of two point phase space density correlation at small scales. Macroscopically, trapped ion granulations excite potential fluctuations that do not satisfy dispersion relation and so broaden frequency spectrum. The line width from emission due only to trapped ion granulations is calculated. The result shows that the line width depends on ion free energy and electron dissipation, which implies that non-adiabatic electrons are essential to recover non-trivial dynamics of trapped ion granulations. Relevant testable predictions are summarized.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Theory of exciton transfer and diffusion in conjugated polymers

We describe a theory of Förster-type exciton transfer between conjugated polymers. The theory is built on three assumptions. First, we assume that the low-lying excited states of conjugated polymers are Frenkel excitons coupled to local normal modes, and described by the Frenkel-Holstein model. Second, we assume that the relevant parameter regime is ℏω < J, i.e., the adiabatic regime, and thus the Born-Oppenheimer factorization of the electronic and nuclear degrees of freedom is generally applicable. Finally, we assume that the Condon approximation is valid, i.e., the exciton-polaron wavefunction is essentially independent of the normal modes. The resulting expression for the exciton transfer rate has a familiar form, being a function of the exciton transfer integral and the effective Franck-Condon factors. The effective Franck-Condon factors are functions of the effective Huang-Rhys parameters, which are inversely proportional to the chromophore size. The Born-Oppenheimer expressions were checked against DMRG calculations, and are found to be within 10% of the exact value for a tiny fraction of the computational cost. This theory of exciton transfer is then applied to model exciton migration in conformationally disordered poly(p-phenylene vinylene). Key to this modeling is the assumption that the donor and acceptor chromophores are defined by local exciton ground states (LEGSs). Since LEGSs are readily determined by the exciton center-of-mass wavefunction, this theory provides a quantitative link between polymer conformation and exciton migration. Our Monte Carlo simulations indicate that the exciton diffusion length depends weakly on the conformation of the polymer, with the diffusion length increasing slightly as the chromophores became straighter and longer. This is largely a geometrical effect: longer and straighter chromophores extend over larger distances. The calculated diffusion lengths of ∼10 nm are in good agreement with experiment. The spectral properties of the migrating excitons are also investigated. The emission intensity ratio of the 0-0 and 0-1 vibronic peaks is related to the effective Huang-Rhys parameter of the emitting state, which in turn is related to the chromophore size. The intensity ratios calculated from the effective Huang-Rhys parameters are in agreement with experimental spectra, and the time-resolved trend for the intensity ratio to decrease with time was also reproduced as the excitation migrates to shorter, lower energy chromophores as a function of time. In addition, the energy of the exciton state shows a logarithmic decrease with time, in agreement with experimental observations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Set statistics in conductive bridge random access memory device with Cu/HfO{sub 2}/Pt structure

The switching parameter variation of resistive switching memory is one of the most important challenges in its application. In this letter, we have studied the set statistics of conductive bridge random access memory with a Cu/HfO{sub 2}/Pt structure. The experimental distributions of the set parameters in several off resistance ranges are shown to nicely fit a Weibull model. The Weibull slopes of the set voltage and current increase and decrease logarithmically with off resistance, respectively. This experimental behavior is perfectly captured by a Monte Carlo simulator based on the cell-based set voltage statistics model and the Quantum Point Contact electron transport model. Our work provides indications for the improvement of the switching uniformity.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗