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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 55 records · Page 3

ELUCID—Exploring the Local Universe with the reConstructed Initial Density Field. II. Reconstruction Diagnostics, Applied to Numerical Halo Catalogs

The ELUCID project aims to build a series of realistic cosmological simulations that reproduce the spatial and mass distributions of the galaxies as observed in the Sloan Digital Sky Survey. This requires powerful reconstruction techniques to create constrained initial conditions (ICs). We test the reconstruction method by applying it to several N -body simulations. We use two medium-resolution simulations, which each produced three additional constrained N -body simulations. We compare the resulting friend-of-friend catalogs by using the particle indexes as tracers, and quantify the quality of the reconstruction by varying the main smoothing parameter. The cross-identification method we use proves to be efficient, and the results suggest that the most massive reconstructed halos are effectively traced from the same Lagrangian regions in the ICs. A preliminary time-dependence analysis indicates that high-mass-end halos converge only at a redshift close to the reconstruction redshift. This suggests that, for earlier snapshots, only collections of progenitors may be effectively cross-identified.

79 ASTRONOMY AND ASTROPHYSICS↗

Oxygen adsorption on spontaneously reconstructed Au(511)

The four-fold site on {100} facets, which are potential catalytic sites on high-curvature gold nanoparticles, is difficult to prepare on a gold single crystal due to surface reconstruction. Here, the Au(511) surface with a high density of step edges and a well-maintained {100} local structure was studied by scanning tunneling microscopy (STM), temperature programmed reaction spectroscopy (TPRS), and density functional theory (DFT) calculations. Annealing at 550 K and 870 K induces reconstruction on the Au(511) surface to a mixture of (311) and (711) micro-terraces. At room temperature and low oxygen coverage, oxygen adsorbs at both three- and four-fold sites on the surface, leading to a well-ordered zig-zag structure. Oxygen atoms cause significant orbital hybridization and a slight displacement of the gold atoms to which they bind. High oxygen coverages induce the formation of clusters, which are not active towards oxidation of isopropanol at room temperature and a pressure of 10-10 mbar. Oxygen adsorption saturates at 1 monolayer (ML), and two separate oxygen recombinative desorption peaks were observed at coverages above 0.11 ML. Our characterization of this surface and the O adsorption structure allows future studies of {100} micro-terraces for oxidation reactions, which contributes to studies on gold-based catalysts with an irregular shape.

catalysis (heterogeneous), mesostructured material↗

Excess Li-Ion Storage on Reconstructed Surfaces of Nanocrystals To Boost Battery Performance

Abstract. Due to the enhanced kinetic properties, nanocrystallites have received much attention as potential electrode materials for energy storage. However, because of the large specific surface areas of nanocrystallites, they usually suffer from decreased energy density, reduced cycling stability and total electrode capacity. In this work, we report a size-dependent excess capacity beyond the theoretical value of 170 mAhg-1 in a special carbon coated LiFePO4 composite cathode material, which delivers capacities of 191.2 and 213.5 mAhg-1 with the mean particle sizes of 83 nm and 42 nm, respectively. Moreover, this LiFePO4 composite also shows excellent cycling stability and high rate performance. Our further experimental tests and ab initio calculations reveal that the excess capacity comes from the charge passivation for which the C-O-Fe bonds would lead to charge redistribution on the surface of LiFePO4 and hence to enhance the bonding interaction between surface O atoms and Li-ions. The surface reconstruction for excess Li-ion storage makes full use of the large specific surface area for the nanocrystallites, which can maintain the fast Li-ion transport and enhance the capacity greatly that the nanocrystallites usually suffers.

Duan, Yandong↗

Highly efficient solid state catalysis by reconstructed (001) Ceria surface

Substrate engineering is a key factor in the synthesis of new complex materials. The substrate surface has to be conditioned in order to minimize the energy threshold for the formation of the desired phase or to enhance the catalytic activity of the substrate. The mechanism of the substrate activity, especially of technologically relevant oxide surfaces, is poorly understood. Here we design and synthesize several distinct and stable CeO2 (001) surface reconstructions which are used to grow epitaxial films of the high-temperature superconductor YBa2Cu3O7. The film grown on the substrate having the longest, fourfold period, reconstruction exhibits a twofold increase in performance over surfaces with shorter period reconstructions. This is explained by the crossover between the nucleation site dimensions and the period of the surface reconstruction. This result opens a new avenue for catalysis mediated solid state synthesis.

Solovyov, VF↗

Graph Neural Network for Object Reconstruction in Liquid Argon Time Projection Chambers

This paper presents a graph neural network (GNN) technique for low-level reconstruction of neutrino interactions in a Liquid Argon Time Projection Chamber (LArTPC). GNNs are still a relatively novel technique, and have shown great promise for similar reconstruction tasks in the LHC. In this paper, a multihead attention message passing network is used to classify the relationship between detector hits by labelling graph edges, determining whether hits were produced by the same underlying particle, and if so, the particle type. The trained model is 84% accurate overall, and performs best on the EM shower and muon track classes. The model’s strengths and weaknesses are discussed, and plans for developing this technique further are summarised.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Nitrogen-induced reconstruction and faceting of Re(112{sup ¯}1)

The surface morphology of Re(112{sup ¯}1), tailored on the nanometer scale by kinetic control of nitrogen, has been investigated using low energy electron diffraction, scanning tunneling microscopy, Auger electron spectroscopy, and density functional theory (DFT) in combination with the ab initio atomistic thermodynamics approach. Experiments show that when exposing to NH{sub 3} (>0.5 L) at 300 K followed by annealing in ultra-high vacuum at 700 K or 900 K, the initially planar Re(112{sup ¯}1) surface becomes (2 × 1) reconstructed or partially faceted, respectively. Upon annealing in 100 L NH{sub 3} at 900 K, Re(112{sup ¯}1) becomes fully faceted and covered by N. The fully faceted surface consists of two-sided ridges formed by (134{sup ¯}2) and (314{sup ¯}2) facets. The (2 × 1) reconstruction may serve as a precursor state for faceting of Re(112{sup ¯}1). The DFT calculations provide an atomistic understanding of facet formation in terms of binding sites and energies of N on Re surfaces of the substrate and facets as well as the corresponding surface phase diagram. The N-covered faceted Re(112{sup ¯}1) surfaces are promising nanoscale model catalysts and nanotemplates. Our findings should be of importance for the design and development of Re-based heterogeneous catalysts operating under nitrogen-rich conditions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Magnetic diagnostics for equilibrium reconstructions with eddy currents on the lithium tokamak experiment

The Lithium Tokamak eXperiment is a spherical tokamak with a close-fitting low-recycling wall composed of thin lithium layers evaporated onto a stainless steel-lined copper shell. Long-lived non-axisymmetric eddy currents are induced in the shell and vacuum vessel by transient plasma and coil currents and these eddy currents influence both the plasma and the magnetic diagnostic signals that are used as constraints for equilibrium reconstruction. A newly installed set of re-entrant magnetic diagnostics and internal saddle flux loops, compatible with high-temperatures and lithium environments, is discussed. Details of the axisymmetric (2D) and non-axisymmetric (3D) treatments of the eddy currents and the equilibrium reconstruction are presented.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

On three-dimensional reconstruction of a neutron/x-ray source from very few two-dimensional projections

The neutron imaging system at the National Ignition Facility is an important diagnostic tool for measuring the two-dimensional size and shape of the source of neutrons produced in the burning deuterium-tritium plasma during the stagnation phase of inertial confinement fusion implosions. Very few two-dimensional projections of neutron images are available to reconstruct the three-dimensional neutron source. In this paper, we present a technique that has been developed for the 3D reconstruction of neutron and x-ray sources from a minimal number of 2D projections. We present the detailed algorithms used for this characterization and the results of reconstructed sources from experimental data collected at Omega.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Enhancing Neutrino Event Reconstruction with Pixel-Based 3D Readout for Liquid Argon Time Projection Chambers

In this paper we explore the potential improvements in neutrino event reconstruction that a 3D pixelated readout could offer over a 2D projective wire readout for liquid argon time projection chambers. We simulate and study events in two generic, idealized detector configurations for these two designs, classifying events in each sample with deep convolutional neural networks to compare the best 2D results to the best 3D results. In almost all cases we find that the 3D readout provides better reconstruction efficiency and purity than the 2D projective wire readout, with the advantages of 3D being particularly evident in more complex topologies, such as electron neutrino charged current events. We conclude that the use of a 3D pixelated detector could significantly enhance the reach and impact of future liquid argon TPC experiments physics program, such as DUNE.

Adams, C↗

Measurement of the decay B → D ℓ ν ℓ in fully reconstructed events and determination of the Cabibbo-Kobayashi-Maskawa matrix element | V c b |

We present a determination of the magnitude of the Cabibbo-Kobayashi-Maskawa matrix element |Vcb| using the decay B → Dℓν ℓ (ℓ = e,μ) based on 711 fb –1 of e + e – → Υ(4S) data recorded by the Belle detector and containing 772 × 10 6 BB¯ pairs. Here, one B meson in the event is fully reconstructed in a hadronic decay mode, while the other, on the signal side, is partially reconstructed from a charged lepton and either a D + or D 0 meson in a total of 23 hadronic decay modes. The isospin-averaged branching fraction of the decay B → Dℓν ℓ is found to be B(B 0 → D – ℓ + ν ℓ ) = (2.31 ± 0.03(stat) ± 0.11(syst))%. Analyzing the differential decay rate as a function of the hadronic recoil with the parametrization of Caprini, Lellouch, and Neubert and using the form-factor prediction G(1) = 1.0541 ± 0.0083 calculated by FNAL/MILC, we obtain η EW |V cb | = (40.12 ± 1.34) × 10 –3 , where ηEW is the electroweak correction factor. Alternatively, assuming the model-independent form-factor parametrization of Boyd, Grinstein, and Lebed and using lattice QCD data from the FNAL/MILC and HPQCD collaborations, we find η EW |V cb | = (41.10 ± 1.14) × 10 –3 .

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Expediting model-based optoacoustic reconstructions with tomographic symmetries

Purpose: Image quantification in optoacoustic tomography implies the use of accurate forward models of excitation, propagation, and detection of optoacoustic signals while inversions with high spatial resolution usually involve very large matrices, leading to unreasonably long computation times. The development of fast and memory efficient model-based approaches represents then an important challenge to advance on the quantitative and dynamic imaging capabilities of tomographic optoacoustic imaging. Methods: Herein, a method for simplification and acceleration of model-based inversions, relying on inherent symmetries present in common tomographic acquisition geometries, has been introduced. The method is showcased for the case of cylindrical symmetries by using polar image discretization of the time-domain optoacoustic forward model combined with efficient storage and inversion strategies. Results: The suggested methodology is shown to render fast and accurate model-based inversions in both numerical simulations andpost mortem small animal experiments. In case of a full-view detection scheme, the memory requirements are reduced by one order of magnitude while high-resolution reconstructions are achieved at video rate. Conclusions: By considering the rotational symmetry present in many tomographic optoacoustic imaging systems, the proposed methodology allows exploiting the advantages of model-based algorithms with feasible computational requirements and fast reconstruction times, so that its convenience and general applicability in optoacoustic imaging systems with tomographic symmetries is anticipated.

62 RADIOLOGY AND NUCLEAR MEDICINE↗

Poster — Thur Eve — 07: Simultaneous reconstruction of both true and scattered coincidences using a Generalized Scatter reconstruction algorithm in PET

Introduction: Scattered coincidences in PET are generally taken as noise, which reduces image contrast and compromises quantification. We have developed a method, with promising results, to reconstruct activity distribution from scattered PET events instead of simply correcting for them. The implementation of this method on clinical PET scanners is however limited by the currently available detector energy resolution. With low energy resolution we lose the ability to distinguish scattered coincidences from true events based on the measured photon energy. In addition the two circular arcs used to confine the source position for a scattered event cannot be accurately defined. Method: This paper presents a modification to this approach which accounts for limited energy resolution. A measured event is split into a true and a scattered component each with different probabilities based on the position of the pair of photon energies in the energy spectrum. For the scattered component, we model the photon energy with a Gaussian distribution and the upper and lower energy limits can be estimated and used to define inner and outer circular arcs to confine the source position. The true and scattered components for each measured event were reconstructed using our Generalized Scatter reconstruction algorithm. Results and Conclusion: The results show that the contrast and noise properties were improved by 6–9% and 2–4% respectively. This demonstrates that the performance of the algorithm is less sensitive to the energy resolution and that incorporating scattered photons into reconstruction brings more benefits than simply rejecting them.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Enhanced nearfield acoustic holography for larger distances of reconstructions using fixed parameter Tikhonov regularization

This paper evaluates the performance of various regularization parameter choice methods applied to different approaches of nearfield acoustic holography when a very nearfield measurement is not possible. For a fixed grid resolution, the larger the hologram distance, the larger the error in the naive nearfield acoustic holography reconstructions. These errors can be smoothed out by using an appropriate order of regularization. In conclusion, this study shows that by using a fixed/manual choice of regularization parameter, instead of automated parameter choice methods, reasonably accurate reconstructions can be obtained even when the hologram distance is 16 times larger than the grid resolution.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Measurement of the muon reconstruction performance of the ATLAS detector using 2011 and 2012 LHC proton–proton collision data

This study presents the performance of the ATLAS muon reconstruction during the LHC run with pp collisions at √s = 7–8 TeV in 2011–2012, focusing mainly on data collected in 2012. Measurements of the reconstruction efficiency and of the momentum scale and resolution, based on large reference samples of J/ψ → μμ, Z → μμ and Υ → μμ decays, are presented and compared to Monte Carlo simulations. Corrections to the simulation, to be used in physics analysis, are provided. Over most of the covered phase space (muon |η| < 2.7 and 5 ≲ p T ≲ 100 GeV) the efficiency is above 99% and is measured with per-mille precision. The momentum resolution ranges from 1.7% at central rapidity and for transverse momentum p T ≃ 10 GeV, to 4% at large rapidity and p T ≃ 100 GeV. The momentum scale is known with an uncertainty of 0.05% to 0.2% depending on rapidity. A method for the recovery of final state radiation from the muons is also presented.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Measurement of $WW/WZ \rightarrow \ell \nu q q^{\prime }$ production with the hadronically decaying boson reconstructed as one or two jets in $pp$ collisions at $\sqrt{s} =8~\text {TeV}$ with ATLAS, and constraints on anomalous gauge couplings

This paper presents a study of the production of WW or WZ boson pairs, with one W boson decaying to e? or µv and one W or Z boson decaying hadronically. The analysis uses 20.2fb -1 of s=8TeVpp collision data, collected by the ATLAS detector at the Large Hadron Collider. Cross-sections for WW / WZ production are measured in high-p T fiducial regions defined close to the experimental event selection. The cross-section is measured for the case where the hadronically decaying boson is reconstructed as two resolved jets, and the case where it is reconstructed as a single jet. The transverse momentum distribution of the hadronically decaying boson is used to search for new physics. Observations are consistent with the Standard Model predictions, and 95% confidence intervals are calculated for parameters describing anomalous triple gauge-boson couplings.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Evaluation of the Reconstruction Accuracy of the Ultrasound Model–Based Image Reconstruction (U-MBIR) Method for Concrete to Optimize Damage Detection

Reinforced concrete is a critical structural material used to construct nuclear power plants (NPPs). As such, its safety and performance must be thoroughly examined throughout the life cycle of the NPP infrastructure system. Ultrasonic measurements have been an industry standard for both surface and subsurface inspections. To support the development of these techniques, Oak Ridge National Laboratory (ORNL) has researched and developed advanced image reconstruction algorithms to capture internal damage. The results and discussion presented herein summarize the current state of the ultrasonic model–based iterative reconstruction (U-MBIR) algorithm developed at ORNL. In the work documented in this report, the U-MBIR methodology was applied to four sets of ultrasonic data collected from concrete specimens. The results demonstrate that the U-MBIR algorithm can successfully detect defects within the four concrete samples. The reconstruction images help identify the specimen thickness, regions of delamination, and location of rebar embedded within the concrete. The reconstruction images allow engineers and technicians to characterize the internal defects within concrete specimens and structural members. Ultimately, this knowledge can guide engineers in making informed decisions regarding the performance, safety, and reliability of structural materials (i.e., reinforced concrete) throughout the life cycle of NPPs.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Implementation of ACTS into sPHENIX Track Reconstruction

Abstract sPHENIX is a high energy nuclear physics experiment under construction at the Relativistic Heavy Ion Collider at Brookhaven National Laboratory (BNL). The primary physics goals of sPHENIX are to study the quark-gluon-plasma, as well as the partonic structure of protons and nuclei, by measuring jets, their substructure, and heavy flavor hadrons in $$p$$ p $$+$$ + $$p$$ p , p + Au, and Au + Au collisions. sPHENIX will collect approximately 300 PB of data over three run periods, to be analyzed using available computing resources at BNL; thus, performing track reconstruction in a timely manner is a challenge due to the high occupancy of heavy ion collision events. The sPHENIX experiment has recently implemented the A Common Tracking Software (ACTS) track reconstruction toolkit with the goal of reconstructing tracks with high efficiency and within a computational budget of 5 s per minimum bias event. This paper reports the performance status of ACTS as the default track fitting tool within sPHENIX, including discussion of the first implementation of a time projection chamber geometry within ACTS.

97 MATHEMATICS AND COMPUTING↗