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At least 721 records · Page 40

An outer gap model of high-energy emission from rotation-powered pulsars

We describe a refined calculation of high-energy emission from rotation-powered pulsars based on the outer gap model of Cheng, Ho, & Ruderman (1986 a, b). In this calculation, vacuum gaps form in regions near the speed-of-light cylinder of the pulsar magnetosphere along the boundary between the closed and open field line zones. We have improved upon previous efforts to model the spectra from these pulsars (e.g., Cheng et al. 1986b; Ho 1989) by following the variation in particle production and radiation properties with position in the outer gap. Curvature, synchotron, and inverse-Compton scattering fluxes vary significantly over the gap, and their interactions via photon-photon pair production build up the radiating charge populations at varying rates. We have also incorporated an approximate treatment of the transport particle and photon fluxes between gap emission zones. These effects, along with improved computations of the particle and photon distribution, provide very important modifications of the model gamma-ray flux. In paticular, we attempt to make specific predictions of pulse profile shapes and spectral variations as a function of pulse phase and suggest further extensions to the model which may provide accurate computations of the observed high-energy emissions.

Chiang, James↗

Structure of an anti-HIV-1 hammerhead ribozyme complex with a 17-mer DNA substrate analog of HIV-1 gag RNA and a mechanism for the cleavage reaction: 750 MHz NMR and computer experiments

The structure of an anti-HIV-1 ribozyme-DNA abortive substrate complex was investigated by 750 MHz NMR and computer modeling experiments. The ribozyme was a chimeric molecule with 30 residues-18 DNA nucleotides, and 12 RNA residues in the conserved core. The DNA substrate analog had 17 residues. The chimeric ribozyme and the DNA substrate formed a shortened ribozyme-abortive substrate complex of 47 nucleotides with two DNA stems (stems I and III) and a loop consisting of the conserved core residues. Circular dichroism spectra showed that the DNA stems assume A-family conformation at the NMR concentration and a temperature of 15 degrees C, contrary to the conventional wisdom that DNA duplexes in aqueous solution populate entirely in the B-form. It is proposed that the A-family RNA residues at the core expand the A-family initiated at the core into the DNA stems because of the large free energy requirement for the formation of A/B junctions. Assignments of the base H8/H6 protons and H1' of the 47 residues were made by a NOESY walk. In addition to the methyl groups of all T's, the imino resonances of stems I and III and AH2's were assigned from appropriate NOESY walks. The extracted NMR data along with available crystallographic data, were used to derive a structural model of the complex. Stems I and III of the final model displayed a remarkable similarity to the A form of DNA; in stem III, a GC base pair was found to be moving into the floor of the minor groove defined by flanking AT pairs; data suggest the formation of a buckled rhombic structure with the adjacent pair; in addition, the base pair at the interface of stem III and the loop region displayed deformed geometry. The loop with the catalytic core, and the immediate region of the stems displayed conformational multiplicity within the NMR time scale. A catalytic mechanism for ribozyme action based on the derived structure, and consistent with biochemical data in the literature, is proposed. The complex between the anti HIV-1 gag ribozyme and its abortive DNA substrate manifests in the detection of a continuous track of A.T base pairs; this suggests that the interaction between the ribozyme and its DNA substrate is stronger than the one observed in the case of the free ribozyme where the bases in stem I and stem III regions interact strongly with the ribozyme core region (Sarma, R. H., et al. FEBS Letters 375, 317-23, 1995). The complex formation provides certain guidelines in the design of suitable therapeutic ribozymes. If the residues in the ribozyme stem regions interact with the conserved core, it may either prevent or interfere with the formation of a catalytically active tertiary structure.

NASA Discipline Exobiology↗

Development of a Telescope for Medium-Energy Gamma-Ray Astronomy

Since the launch of AGILE and FERMI, the scientific progress in high-energy (E(sub gamma) greater than approximately 200 MeV) gamma-ray science has been, and will continue to be dramatic. Both of these telescopes cover a broad energy range from approximately 20 MeV to greater than 10 GeV. However, neither instrument is optimized for observations below approximately 200 MeV where many astrophysical objects exhibit unique, transitory behavior, such as spectral breaks, bursts, and flares. Hence, while significant progress from current observations is expected, there will nonetheless remain a significant sensitivity gap in the medium-energy (approximately 0.1-200 MeV) regime; the lower end of this range remains largely unexplored whereas the upper end will allow comparison with FERMI data. Tapping into this unexplored regime requires significant improvements in sensitivity. A major emphasis of modern detector development, with the goal of providing significant improvements in sensitivity in the medium-energy regime, focuses on high-resolution electron tracking. The Three-Dimensional Track Imager (3-DTI) technology being developed at GSFC provides high resolution tracking of the electron-positron pair from gamma-ray interactions from 5 to 200 MeV. The 3-DTI consists of a time projection chamber (TPC) and 2-D cross-strip microwell detector (MWD). The low-density and homogeneous design of the 3-DTI, offers unprecedented sensitivity by providing angular resolution near the kinematic limit. Electron tracking also enables measurement of gamma-ray polarization, a new tool to study astrophysical phenomenon. We describe the design, fabrication, and performance of a 30x30x30 cubic centimeters 3-DTI detector prototype of a medium-energy gamma-ray telescope.

Hunter, Stanley D.↗

Development of a Telescope for Medium-Energy Gamma-ray Astronomy

Since the launch of AGILE and FERMI, the scientific progress in high-energy (Eg greater than approximately 200 MeV) gamma-ray science has been, and will continue to be dramatic. Both of these telescopes cover a broad energy range from approximately 20 MeV to greater than 10 GeV. However, neither instrument is optimized for observations below approximately 200 MeV where many astrophysical objects exhibit unique, transitory behavior, such as spectral breaks, bursts, and flares. Hence, while significant progress from current observations is expected, there will nonetheless remain a significant sensitivity gap in the medium-energy (approximately 0.1-200 MeV) regime; the lower end of this range remains largely unexplored whereas the upper end will allow comparison with FERMI data. Tapping into this unexplored regime requires significant improvements in sensitivity. A major emphasis of modern detector development, with the goal of providing significant improvements in sensitivity in the medium-energy regime, focuses on high-resolution electron tracking. The Three-Dimensional Track Imager (3-DTI) technology being developed at GSFC provides high resolution tracking of the electron-positron pair from gamma-ray interactions from 5 to 200 MeV. The 3-DTI consists of a time projection chamber (TPC) and 2-D cross-strip microwell detector (MWD). The low-density and homogeneous design of the 3-DTI, offers unprecedented sensitivity by providing angular resolution near the kinematic limit. Electron tracking also enables measurement of gamma-ray polarization, a new tool to study astrophysical phenomenon. We describe the design, fabrication, and performance of a 30x30x30 cm3 3-DTI detector prototype of a medium-energy gamma-ray telescope.

Sunter, Stan↗

The Extragalactic Background Light and the Gamma-ray Opacity of the Universe

The extragalactic background light (EBL) is one of the fundamental observational quantities in cosmology. All energy releases from resolved and unresolved extragalactic sources, and the light from any truly diffuse background, excluding the cosmic microwave background (CMB), contribute to its intensity and spectral energy distribution. It therefore plays a crucial role in cosmological tests for the formation and evolution of stellar objects and galaxies, and for setting limits on exotic energy releases in the universe. The EBL also plays an important role in the propagation of very high energy gamma-rays which are attenuated en route to Earth by pair producing gamma-gamma interactions with the EBL and CMB. The EBL affects the spectrum of the sources, predominantly blazars, in the approx 10 GeV to 10 TeV energy regime. Knowledge of the EBL intensity and spectrum will allow the determination of the intrinsic blazar spectrum in a crucial energy regime that can be used to test particle acceleration mechanisms and VHE gamma-ray production models. Conversely, knowledge of the intrinsic gamma-ray spectrum and the detection of blazars at increasingly higher redshifts will set strong limits on the EBL and its evolution. This paper reviews the latest developments in the determination of the EBL and its impact on the current understanding of the origin and production mechanisms of gamma-rays in blazars, and on energy releases in the universe. The review concludes with a summary and future directions in Cherenkov Telescope Array techniques and in infrared ground-based and space observatories that will greatly improve our knowledge of the EBL and the origin and production of very high energy gamma-rays.

Dwek, Eli↗

Launch Lock Assemblies with Reduced Preload and Spacecraft Isolation Systems Including the Same

Launch lock assemblies with reduced preload are provided. The launch lock assembly comprises first and second mount pieces, a releasable clamp device, and a pair of retracting assemblies. Each retracting assembly comprises a pair of toothed members having interacting toothed surfaces. The releasable clamp device normally maintains the first and second mount pieces in clamped engagement. When the releasable clamp device is actuated, the first and second mount pieces are released from clamped engagement and one toothed member of each retracting assembly moves in an opposite direction relative to the other one toothed member of the other retracting assembly to define an axial gap on each side of the first mount piece.

Barber, Tim Daniel↗

Construction and Modeling of a Coculture Microplate for Real-Time Measurement of Microbial Interactions

The dynamic structures of microbial communities emerge from the complex network of interactions between their constituent microorganisms. Quantitative measurements of these interactions are important for understanding and engineering ecosystem structure. Here, we present the development and application of the BioMe plate, a redesigned microplate device in which pairs of wells are separated by porous membranes. BioMe facilitates the measurement of dynamic microbial interactions and integrates easily with standard laboratory equipment. We first applied BioMe to recapitulate recently characterized, natural symbiotic interactions between bacteria isolated from the Drosophila melanogaster gut microbiome. Specifically, the BioMe plate allowed us to observe the benefit provided by two Lactobacillus strains to an Acetobacter strain. We next explored the use of BioMe to gain quantitative insight into the engineered obligate syntrophic interaction between a pair of Escherichia coli amino acid auxotrophs. We integrated experimental observations with a mechanistic computational model to quantify key parameters associated with this syntrophic interaction, including metabolite secretion and diffusion rates. This model also allowed us to explain the slow growth observed for auxotrophs growing in adjacent wells by demonstrating that, under the relevant range of parameters, local exchange between auxotrophs is essential for efficient growth. The BioMe plate provides a scalable and flexible approach for the study of dynamic microbial interactions.

3D printed device↗

Modeling dissociation of ionic liquids with electrolyte NRTL model

Dissociation of ionic liquids (ILs) is critical to electrochemical process performance by affecting ionic conductivity. Prior studies of thermodynamic modeling either assumed no dissociation or complete dissociation that were not consistent with experimental observations. This work presented an eNRTL model for three aqueous imidazolium-based IL systems: [Emim][EtSO 4 ], [Emim][TFA], and [Emim][TfO]. The model accurately correlates the IL dissociation and VLE data in the entire concentration range from pure IL to infinite dilution aqueous solution. The system non-ideality is dominated by the dissociation chemistry. Dissociation behavior is driven by strong short-range interaction of the molecular IL-water pair relative to the dissociated IL-water pair, consistent with prior studies indicating that molecular IL and water can form an energetically favorable complex. The interaction energy parameters calculated in this work qualitatively agrees with the hydrogen bonding ability of the anions previously reported. This research not only provides a model that well describes the IL dissociation but also demonstrates the physical significance of eNRTL model.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Angle-resolved photoemission spectroscopy of a Fermi–Hubbard system

Angle-resolved photoemission spectroscopy (ARPES) measures the single-particle excitations of a many-body quantum system with energy and momentum resolution, providing detailed information about strongly interacting materials. ARPES directly probes fermion pairing, and hence is a natural technique to study the development of superconductivity in systems ranging from high-temperature superconductors to unitary Fermi gases. In these systems, a remnant gap-like feature persists in the normal state. Developing a quantitative understanding of these so-called pseudogap regimes may elucidate details about the pairing mechanisms that lead to superconductivity, but this is difficult in real materials partly because the microscopic Hamiltonian is not known. Here, we report on the development of ARPES to study strongly interacting fermions in an optical lattice using a quantum gas microscope. We benchmark the technique by measuring the occupied single-particle spectral function of an attractive Fermi–Hubbard system across the BCS–BEC crossover and comparing the results to those of quantum Monte Carlo calculations. We find evidence for a pseudogap that opens well above the expected critical temperature for superfluidity. This technique may also be applied to the doped repulsive Hubbard model, which is expected to exhibit a pseudogap at temperatures close to those achieved in recent experiments.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

The Interplay of Solvation and Polarization Effects on Ion Pairing in Nanoconfined Electrolytes

The nature of ion–ion interactions in electrolytes confined to nanoscale pores has important implications for energy storage and separation technologies. However, the physical effects dictating the structure of nanoconfined electrolytes remain debated. Here we employ machine-learning-based molecular dynamics simulations to investigate ion–ion interactions with density functional theory level accuracy in a prototypical confined electrolyte, aqueous NaCl within graphene slit pores. We find that the free energy of ion pairing in highly confined electrolytes deviates substantially from that in bulk solutions, observing a decrease in contact ion pairing but an increase in solvent-separated ion pairing. These changes arise from an interplay of ion solvation effects and graphene’s electronic structure. Notably, the behavior observed from our first-principles-level simulations is not reproduced even qualitatively with the classical force fields conventionally used to model these systems. The insight provided in this work opens new avenues for predicting and controlling the structure of nanoconfined electrolytes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Three views of two giant streams: Aligned observations at 1 AU, 4.6 AU, and 5.9 AU

A close radial alignment of the Interplanetary Monitoring Platform (IMP) and Pioneers 10 and 11 spacecraft in 1974 allows a nearly unambiguous, empirical study of the radial evolution of the interaction regions of two contrasting weak and strong, giant streams. The study confirms the main aspects of the standard model of corotating interaction regions: an expanding and strengthening pair of forward-reverse shocks sandwich a stream interface. It adds the follwoing concepts: stream group speed--the speed at the stream interface tends to remain constant with distance; corotating stream complexes--interaction regions can include features like noncompressive density enhancements and streamer belts; secondary interfaces--a possible precursor to the reverse shock; and emerging stream interfaces--one emerged between 1 AU and 4.6 AU. The study uses the conservation specific entropy to correlate features between spacecraft.

Siscoe, George↗

Thermodynamic modeling of calcium carbonate scale precipitation: aqueous Na + -Ca 2+ -Cl – -HCO 3 – -CO 3 2– -CO 2 system

To allow for accurate calculations of calcium carbonate scaling in highly saline produced waters, we present a comprehensive thermodynamic model based on the electrolyte nonrandom two-liquid (eNRTL) activity coefficient equation for the aqueous Na ⁺ -Ca ²⁺ -Cl – -HCO 3 – -CO 3 ²– -CO 2 system. The eNRTL binary interaction parameters for the H 2 O:(Na ⁺ -CO 3 2– ) pair, the H 2 O:(Na ⁺ -HCO 3 – ) pair, the (Na⁺-Cl–):(Na ⁺ -CO 3 2– ) pair, and the (Na ⁺ -Cl – ):(Na ⁺ -HCO 3 – ) pair are identified in this work via the regression of thermodynamic, calorimetric, and phase equilibria experimental data. The binary interaction parameters associated with the H 2 O:(Na ⁺ -Cl – ) pair, the CO 2 :(Na ⁺ -Cl – ) pair, the H 2 O:(Ca ²⁺ -Cl – ) pair, and the (Na ⁺ -Cl – ):(Ca ²⁺ -Cl – ) pair are retrieved from the literature. The remaining binary interaction parameters are retrieved from Aspen Plus or set to zero. In addition, the solubility product constants are identified for Na 2 CO 3 ·10H 2 O (s) , Na 2 CO 3 · 7H 2 O (s) , Na 2 CO 3 ·H 2 O (s) , Na 2 CO 3 ·NaHCO 3 2H 2 O (s) , Na 2 CO 3 ·3NaHCO 3 (s) , and CaCO 3(s) via regression of solubility data. Here, the model is capable of accurately calculating all phase equilibria and calorimetric properties at temperatures up to 473.15 K and salt concentrations up to saturation.

42 ENGINEERING↗

Impact of long-range electrostatic and dispersive interactions on theoretical predictions of adsorption and catalysis in zeolites

In this article, we review the importance of long-range zeolite framework interactions in theoretical predictions for a variety of zeolite-catalyzed processes, and we show why such interactions must be determined accurately in order to reproduce experimentally measured adsorption and activation energies. We begin with an overview of the different strategies that have been used to account for long-range coulombic and dispersive interactions of zeolite framework atoms with species adsorbed at an active site. These methods include full periodic-DFT calculations and multi-layer hybrid techniques. Electrostatic interactions are observed to have a more significant impact than dispersive interactions on the geometries of ion-pair transition states and adsorbed species. Stabilization of the TS relative to reactant complexes is also dictated by electrostatic interactions. Dispersion effects are found to significantly stabilize both transition and reactant states for adsorbed species, especially those which have dimensions that provide good fits within the zeolite pore or cavity. We also show that the relevance of particular active site configurations can be missed, if the effects of long-range interactions are neglected. As a case in point, we demonstrate that a site previously considered inactive for ethane dehydrogenation, [GaH 2 ] + may in fact be more active than previously thought, when the impact of long-range interactions on the predicted activation energy is taken into account. In conclusion, the use of hybrid quantum mechanics/molecular mechanics approaches on extended, finite zeolite clusters has emerged as an accurate, highly cost-effective, and versatile alternative towards overcoming some of the present-day limitations of periodic calculations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Neutrino and pair creation in reconnection-powered coronae of accreting black holes

A ubiquitous feature of accreting black hole systems is their hard X-ray emission which is thought to be produced through Comptonization of soft photons by electrons and positrons in the vicinity of the black hole, in a region with optical depth of order unity. The origin and composition of this Comptonizing region, known as the corona, is a matter open for debate. In this paper we investigate the role of relativistic protons accelerated in black-hole magnetospheric current sheets for the pair enrichment and neutrino emission of AGN coronae. Our model has two free parameters, namely the proton plasma magnetization σ p , which controls the peak energy of the neutrino spectrum, and the Eddington ratio λ X,Edd (defined as the ratio between X-ray luminosity L X and Eddington luminosity L Edd ), which controls the amount of energy transferred to secondary particles. For sources with λ X,Edd ≳ λ Edd,crit (where λ Edd,crit ∼ 10 -1 for σ p = 10 5 or ∼ 10 -2 for σ p = 10 7 ), proton-photon interactions and γγ annihilation produce enough secondary pairs to achieve Thomson optical depths τ T ∼ 0.1-10. In the opposite case of λ X,Edd ≲ λ Edd,crit , the coronal pairs cannot originate only from hadronic interactions. Additionally, we find that the neutrino luminosity scales as L 2 X /L Edd for λ X,Edd ≲ λ Edd,crit , while it is proportional to L X for higher λ X,Edd values. We apply our model to four Seyfert galaxies, including NGC 1068, and discuss our results in light of recent IceCube observations.

active galactic nuclei↗

Search for the flavor-changing neutral current interactions of the top quark and the Higgs boson which decays into a pair of b quarks at $\sqrt{s}=$ 13 TeV

A search for flavor-changing neutral currents (FCNC) in events with the top quark and the Higgs boson is presented. The Higgs boson decay to a pair of b quarks is considered. The data sample corresponds to an integrated luminosity of 35.9 fb$^{−1}$ recorded by the CMS experiment at the LHC in proton-proton collisions at $ \sqrt{s}=13 $ TeV. Two channels are considered: single top quark FCNC production in association with the Higgs boson (pp → tH), and top quark pair production with FCNC decay of the top quark (t → qH). Final states with one isolated lepton and at least three reconstructed jets, among which at least two are associated with b quarks, are studied. No significant deviation is observed from the predicted background. Observed (expected) upper limits at 95% confidence level are set on the branching fractions of top quark decays, ℬ(t → uH) < 0.47% (0.34%) and ℬ(t → cH) < 0.47% (0.44%), assuming a single nonzero FCNC coupling.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Toward Understanding Wake Vortices and Atmospheric Turbulence Interactions Using Large-Eddy Simulation

The vortices produced by an aircraft in flight are a complex phenomena created from a 'sheet of vorticity' leaving the trailing edge of the aircraft surfaces. This sheet tends to roll-up into two counter-rotating vortices. After a few spans downstream of the aircraft, the roll-up process is complete and the vortex pair may be characterized in a simple manner for modeling purposes. Our research will focus on what happens to these post roll-up vortices in the vicinity of an airport terminal. As the aircraft wake vortices descend, they are transported by the air mass which they are embedded and are decayed by both internal and external processes. In the vicinity of the airport, these external influences are usually due to planetary boundary layer (PBL) turbulence. Using large-eddy simulation (LES), one may simulate a variety of PBL conditions. In the LES method, turbulence is generated in the PBL as a response to surface heat flux, horizontal pressure gradient, wind shear, and/or stratification, and may produce convective or unstably stratified, neutral, or stably stratified PBL's. Each of these PBL types can occur during a typical diurnal cycle of the PBL. Thus it is important to be able to characterize these conditions with the LES method. Once this turbulent environment has been generated, a vortex pair will be introduced and the interactions are observed. The objective is to be able to quantify the PBL turbulence vortex interaction and be able to draw some conclusions of vortex behavior from the various scale interactions. This research is ongoing, and we will focus on what has been accomplished to date and the future direction of this research. We will discuss the model being used, show results that validate its use in the PBL, and present a nested-grid method proposed to analyze the entire PBL and vortex pair simultaneously.

DeCroix, David↗

Study of Unboosted Higgs Pair Production with HH to bbWW Decay with the CMS experiment at the LHC

Measurement of the Higgs boson self-interaction through the production of Higgs boson (H) pairs is critical for understanding the shape of the Higgs potential and the stability of the universe. Higgs pair production (HH) where one H decays to b quarks (H to bb) and the other to hadronically decaying W bosons (H to WW*→qqqq) has a large branching fraction with the cost of high background from jets produced through quantum chromodynamics (QCD). While previous all-hadronic HH→bbWW analyses focused on the few percent of highly energetic HH events with collimated decay products, this first study of its kind targets the more challenging 95$\%$ of HH to bbWW* in which decay products can be reconstructed as separate jets providing sensitivity to a complementary region of phase space. This poster focuses on generator level measurements of the fractions of HH to bbWW* signal events are fully or partially reconstructed and what fraction are impacted by contamination from high momentum jets from initial or final state radiation. Partially reconstructed events are further classified according to whether the H to bb, H to WW*, or W to qq are fully reconstructed

Gillespie, Emma [U. Louisville]↗

Integrative genomics analyses unveil downstream biological effectors of disease-specific polymorphisms buried in intergenic regions

Functionally altered biological mechanisms arising from disease-associated polymorphisms, remain difficult to characterise when those variants are intergenic, or, fall between genes. We sought to identify shared downstream mechanisms by which inter- and intragenic single-nucleotide polymorphisms (SNPs) contribute to a specific physiopathology. Using computational modelling of 2 million pairs of disease-associated SNPs drawn from genome-wide association studies (GWAS), integrated with expression Quantitative Trait Loci (eQTL) and Gene Ontology functional annotations, we predicted 3,870 inter–intra and inter–intra SNP pairs with convergent biological mechanisms (FDRo0.05). These prioritised SNP pairs with overlapping messenger RNA targets or similar functional annotations were more likely to be associated with the same disease than unrelated pathologies (OR412). We additionally confirmed synergistic and antagonistic genetic interactions for a subset of prioritised SNP pairs in independent studies of Alzheimer’s disease (entropy P = 0.046), bladder cancer (entropy P = 0.039), and rheumatoid arthritis (PheWAS case–control Po10 - 4 ). Using ENCODE data sets, we further statistically validated that the biological mechanisms shared within prioritised SNP pairs are frequently governed by matching transcription factor binding sites and long-range chromatin interactions. These results provide a ‘roadmap’ of disease mechanisms emerging from GWAS and further identify candidate therapeutic targets among downstream effectors of intergenic SNPs.

59 BASIC BIOLOGICAL SCIENCES↗