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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 559 records · Page 31

Steric effects in light-induced solvent proton abstraction

The significance of solvent structural factors in the excited-state proton transfer (ESPT) reactions of Schiff bases with alcohols is reported here. In this work, we use the super photobase FR0-SB and a series of primary, secondary, and tertiary alcohol solvents to illustrate the steric issues associated with solvent to photobase proton transfer. Steady-state and time-resolved fluorescence data show that ESPT occurs readily for primary alcohols, with a probability proportional to the relative –OH concentration. For secondary alcohols, ESPT is greatly diminished, consistent with the barrier heights obtained using quantum chemistry calculations. ESPT is not observed in the tertiary alcohol. We explain ESPT using a model involving an intermediate hydrogen-bonded complex where the proton is “shared” by the Schiff base and the alcohol. The formation of this complex depends on the ability of the alcohol solvent to achieve spatial proximity to and alignment with the FR0-SB* imine lone pair stabilized by the solvent environment.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Reduced ultraviolet light induced degradation and enhanced light harvesting using YVO{sub 4}:Eu{sup 3+} down-shifting nano-phosphor layer in organometal halide perovskite solar cells

We report a simple method to mitigate ultra-violet (UV) degradation in TiO{sub 2} based perovskite solar cells (PSC) using a transparent luminescent down-shifting (DS) YVO{sub 4}:Eu{sup 3+} nano-phosphor layer. The PSC coated with DS phosphor showed an improvement in stability under prolonged illumination retaining more than 50% of its initial efficiency, whereas PSC without the phosphor layer degraded to ∼35% of its initial value. The phosphor layer also provided ∼8.5% enhancement in photocurrent due to DS of incident UV photons into additional red photons. YVO{sub 4}:Eu{sup 3+} layer thus served a bi-functional role in PSC by reducing photo-degradation as well as enhancing energy conversion efficiency.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Calibration of scintillation-light filters for neutron time-of-flight spectrometers at the National Ignition Facility

Sixty-four neutral density filters constructed of metal plates with 88 apertures of varying diameter have been radiographed with a soft x-ray source and CCD camera at National Security Technologies, Livermore. An analysis of the radiographs fits the radial dependence of the apertures’ image intensities to sigmoid functions, which can describe the rapidly decreasing intensity towards the apertures’ edges. The fitted image intensities determine the relative attenuation value of each filter. Absolute attenuation values of several imaged filters, measured in situ during calibration experiments, normalize the relative quantities which are now used in analyses of neutron spectrometer data at the National Ignition Facility.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Spectral shape of a signal in light-induced diffusive pulling (pushing) of particles into a light beam

We study theoretically how the dependences of transport collision frequencies ν{sub i}, collision broadening γ and collision shift Δ of the levels on the velocity v of resonant particles influence lightinduced diffusive pulling (pushing) (LDP) effects in the framework of a generalised model of strong collisions in the case of velocitydependent collision rates (so-called kangaroo model). It is found that allowance for the dependences ν{sub i}(v), γ(v) and Δ(v) does not change the spectral shape of an LDP signal. In particular, in the case of low-intensity radiation, the spectral dependence of the LDP signal coincides with the absorption line shape. It is shown that the magnitude of the LDP effect is proportional to the difference between the diffusion coefficients of particles in the excited and ground states. It is found that the spectral anomalies previously predicted in the LDP effect [Gel'mukhanov F.Kh. JETP Lett., 55, 214 (1992)] for an idealised model of the Lorentz gas (the limiting case of heavy buffer particles), which arise due to the dependences ν{sub i}(v), γ(v) and Δ(v), are typical only for this gas. At a realistic ratio of the masses of absorbing and buffer particles, spectral anomalies do not occur in the LDP effect. (nonlinear optical phenomena)

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Advancements and Application of Microsecond Synchrotron X-ray Footprinting at the Advanced Light Source

The method of synchrotron X-ray protein footprinting (XF-MS) is used to determine protein conformational changes, folding, protein-protein and protein-ligand interactions, providing information which is often difficult to obtain using X-ray crystallography and other common structural biology methods [1–3]. The technique uses comparative in situ labeling of solvent-accessible side chains by highly reactive hydroxyl radicals (•OH) in buffered aqueous solution under different assay conditions. In regions where a protein is folded or binds a partner, these •OH susceptible sites are inaccessible to solvent, and therefore protected from labeling. The •OH are generated by the ionization of water using high-flux-density X-rays. High-flux density is a key factor for XF-MS labeling because obtaining an adequate steady-state concentration of hydroxyl radical within a short irradiation time is necessary to minimize radiation-induced secondary damage and also to overcome various scavenging reactions that reduce the yield of labeled side chains.

47 OTHER INSTRUMENTATION↗

Revealing the structure of light pseudoscalar mesons at the electron–ion collider

The questions of how the bulk of the Universe's visible mass emerges and how it is manifest in the existence and properties of hadrons are profound, and probe the heart of strongly interacting matter. Paradoxically, the lightest pseudoscalar mesons appear to be key to a further understanding of the emergent mass and structure mechanisms. These mesons, namely, the pion and kaon, are the Nambu-Goldstone boson modes of quantum chromodynamics (QCD). Unravelling their partonic structure and the interplay between emergent and Higgs-boson mass mechanisms is a common goal of three interdependent approaches - continuum QCD phenomenology, lattice-regularised QCD, and the global analysis of parton distributions - linked to experimental measurements of hadron structure. Experimentally, the anticipated electron-ion collider will enable a revolution in our ability to study pion and kaon structures, accessed by scattering from the 'meson cloud' of the proton through the Sullivan process. With the goal of enabling a suite of measurements that can address these questions, we examine key reactions that identify the critical detector-system requirements needed to map tagged pion and kaon cross-sections over a wide range of kinematics. The excellent prospects for extracting pion structural, functional, and form-factor data are outlined, and similar prospects for kaon structures are discussed in the context of a worldwide programme. Finally, the successful completion of the programme outlined herein will deliver deep, far-reaching insights into the emergence of pions and kaons, their properties, and their role as QCD's Goldstone boson modes.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Symmetry breaking indication for supergravity inflation in light of the Planck 2015

Supergravity (SUGRA) theories with exact global U(1) symmetry or shift symmetry in Kähler potential provide natural frameworks for inflation. However, quadratic inflation is disfavoured by the new results on primordial tensor fluctuations from the Planck Collaboration. To be consistent with the new Planck data, we point out that the explicit symmetry breaking is needed, and study these two SUGRA inflation in detail. For SUGRA inflation with global U(1) symmetry, the symmetry breaking term leads to a trigonometric modulation on inflaton potential. Coefficient of the U(1) symmetry breaking term is of order 10{sup −2}, which is sufficient large to improve the inflationary predictions while its higher order corrections are negligible. Such models predict sizeable tensor fluctuations and highly agree with the Planck results. In particular, the model with a linear U(1) symmetry breaking term predicts the tensor-to-scalar ratio around r∼0.01 and running spectral index α{sub s∼} −0.004, which comfortably fit with the Planck observations. For SUGRA inflation with breaking shift symmetry, the inflaton potential is modulated by an exponential factor. The modulated linear and quadratic models are consistent with the Planck observations. In both types of models the tensor-to-scalar ratio can be of order 10{sup −2}, which will be tested by the near future observations.

79 ASTRONOMY AND ASTROPHYSICS↗

Cosmic ray propagation and dark matter in light of the latest AMS-02 data

The AMS-02 experiment is measuring the high energy cosmic rays with unprecedented accuracy. We explore the possibility of determining the cosmic-ray propagation models using the AMS-02 data alone. A global Bayesian analysis of the constraints on the cosmic-ray propagation models from the preliminary AMS-02 data on the Boron to Carbon nuclei flux ratio and proton flux is performed, with the assumption that the primary nucleon source is a broken power law in rigidity. The ratio of the diffusion coefficient D{sub 0} to the diffusive halo height Z{sub h} is determined with high accuracy D{sub 0}/Z{sub h}≃2.00±0.07 cm{sup 2}s{sup −1}kpc{sup −1}, and the value of the halo width is found to be Z{sub h}≃3.3 kpc with uncertainty less than 50%. As a consequence, the typical uncertainties in the positron fraction predicted from dark matter (DM) annihilation is reduced to a factor of two, and that in the antiproton flux is about an order of magnitude. Both of them are significantly smaller than that from the analyses prior to AMS-02. Taking into account the uncertainties and correlations in the propagation parameters, we derive conservative upper limits on the cross sections for DM annihilating into various standard model final states from the current PAMELA antiproton data. We also investigate the reconstruction capability of the future high precision AMS-02 antiproton data on the DM properties. The results show that for DM particles lighter than ∼100 GeV and with typical thermal annihilation cross section, the cross section can be well reconstructed with uncertainties about a factor of two for the AMS-02 three-year data taking.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

The contribution of light Majorana neutrinos to neutrinoless double beta decay and cosmology

Cosmology is making impressive progress and it is producing stringent bounds on the sum of the neutrino masses Σ, a parameter of great importance for the current laboratory experiments. In this letter, we exploit the potential relevance of the analysis of Palanque-Delabrouille et al. to the neutrinoless double beta decay (0νββ) search. This analysis indicates small values for the lightest neutrino mass, since the authors find Σ<84 meV at 1σ C.L., and provides a 1σ preference for the normal hierarchy. The allowed values for the Majorana effective mass, probed by 0νββ, turn out to be <75 meV at 3σ C.L. and lower down to less than 20 meV at 1σ C.L. . If this indication is confirmed, the impact on the 0νββ experiments will be tremendous since the possibility of detecting a signal will be out of the reach of the next generation of experiments.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Cosmological imprints of frozen-in light sterile neutrinos

We investigate observable cosmological aspects of sterile neutrino dark matter produced via the freeze-in mechanism. The study is performed in a framework that admits many cosmologically interesting variations: high temperature production via annihilation processes from higher dimensional operators or low temperature production from decays of a scalar, with the decaying scalar in or out of equilibrium with the thermal bath, in supersymmetric or non-supersymmetric setups, thus allowing us to both extract generic properties and highlight features unique to particular variations. We find that while such sterile neutrinos are generally compatible with all cosmological constraints, interesting scenarios can arise where dark matter is cold, warm, or hot, has nontrivial momentum distributions, or provides contributions to the effective number of relativistic degrees of freedom N {sub eff} during Big Bang nucleosynthesis large enough to be probed by future measurements.

79 ASTRONOMY AND ASTROPHYSICS↗

Simulation of argon response and light detection in the DarkSide-50 dual phase TPC

A Geant4-based Monte Carlo package named G4DS has been developed to simulate the response of DarkSide-50, an experiment operating since 2013 at LNGS, designed to detect WIMP interactions in liquid argon. In the process of WIMP searches, DarkSide-50 has achieved two fundamental milestones: the rejection of electron recoil background with a power of ~10 7 , using the pulse shape discrimination technique, and the measurement of the residual 39 Ar contamination in underground argon, ~3 orders of magnitude lower with respect to atmospheric argon. These results rely on the accurate simulation of the detector response to the liquid argon scintillation, its ionization, and electron-ion recombination processes. This work provides a complete overview of the DarkSide Monte Carlo and of its performance, with a particular focus on PARIS, the custom-made liquid argon response model.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

HESS J1640–465 AND HESS J1641–463: TWO INTRIGUING TeV SOURCES IN LIGHT OF NEW FERMI-LAT OBSERVATIONS

We report on γ-ray analysis of the region containing the bright TeV source HESS J1640–465 and the close-by TeV source HESS J1641–463 using 64 months of observations with the Fermi Large Area Telescope (LAT). Previously only one GeV source was reported in this region and was associated with HESS J1640–465. With an increased data set and the improved sensitivity afforded by the reprocessed data (P7REP) of the LAT, we now report the detection, morphological study, and spectral analysis of two distinct sources above 100 MeV. The softest emission in this region comes from the TeV source HESS J1641–463 which is well fitted with a power law of index Γ = 2.47 ± 0.05 ± 0.06 and presents no significant γ-ray signal above 10 GeV, which contrasts with its hard spectrum at TeV energies. The Fermi-LAT spectrum of the second TeV source, HESS J1640–465 is well described by a power-law shape of index Γ = 1.99 ± 0.04 ± 0.07 that links up naturally with the spectral data points obtained by the High Energy Stereoscopic System (H.E.S.S.). These new results provide new constraints concerning the identification of these two puzzling γ-ray sources.

79 ASTRONOMY AND ASTROPHYSICS↗