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At least 343 records · Page 19

COMPASS results on transverse spin asymmetries in identified two-hadron production in SIDIS

COMPASS is a fixed target experiment at CERN where nucleon spin structure and hadron spectroscopy are investigated using a 160 GeV/c polarized μ{sup +} beam. An important part of its physics program are the measurements of single spin asymmetries (SSA) in semi-inclusive deep inelastic scattering (SIDIS) on transversely polarized targets. Data on a deuteron target ({sup 6}LiD) were taken in 2002–04. After taking the first data on a transversely polarized proton target (NH{sub 3}) in 2007, a full year of data taking followed in 2010 to increase precision. The SSA of identified hadron pairs consisting of charged pions and/or kaons from the 2010 data are shown for the first time and compared to model predictions and results from HERMES.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Six “beyond Collins and Sivers” transverse spin asymmetries at COMPASS

COMPASS is a fixed-target high energy physics experiment at the SPS at CERN [1]. One of the important objectives of the experiment is the exploration of the transverse spin structure of the nucleon via spin dependent azimuthal asymmetries in single-hadron production in deep inelastic scattering of polarized leptons off transversely polarized target. For this purpose a series of measurements were made in COMPASS, using 160 GeV/c longitudinally polarized muon beam and transversely polarized {sup 6}LiD (in 2002, 2003 and 2004) and NH{sub 3} (in 2007 and 2010) targets. Till now main attention was focused on Collins and Sivers asymmetries and obtained results play an important role in the general understanding of the three-dimensional nature of the nucleon and mechanism of SIDIS processes in terms of Transverse Momentum Dependent (TMD) Parton Distribution Functions (PDFs) and Fragmentation Functions (FFs). In addition to these two measured leading-twist effects, the SIDIS cross-section counts six more target transverse spin dependent azimuthal effects, which have their own well defined leading or higher-twist interpretation in terms of QCD parton model. So far COMPASS presented preliminary results for these asymmetries from deuteron [2, 3] and “proton-2007” data [4]. In this contribution we review the results obtained with the last “proton-2010” data sample.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Study of heavy hyperons production in DIS at COMPASS

Samples of Λ and Λ-bar hyperons produced in deep-inelastic muon scattering off {sup 6}LiD target were collected with the COMPASS experimental setup at CERN. The relative yields of Σ{sup -}(1385), Σ-bar {sup −}(1385), Σ-bar {sup +}(1385), Ξ{sup −}(1321), and Ξ-bar {sup +}(1321) hyperons decaying into the Λ( Λ-bar )π were measured. The yield ratios of heavy hyperons to Λ were found to be in the range 3.8%–5.6% with a precision of about 10%. The experimental values are used to tune the parameters of the LEPTO Monte-Carlo generator relevant for strange particle production.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Hadron transverse momentum distributions in muon deep inelastic scattering at 160 GeV/c

Multiplicities of charged hadrons produced in deep inelastic muon scattering off a 6 LiD target have been measured as a function of the DIS variables x Bj , Q 2 , W 2 and the final state hadron variables p T and z . The p$2\atop{T}$ distributions are fitted with a single exponential function at low values of p$2\atop{T}$ to determine the dependence of ⟨p$2\atop{T}$⟩ on x Bj , Q 2 , W 2 and z . The z -dependence of ⟨p$2\atop{T}$⟩ is shown to be a potential tool to extract the average intrinsic transverse momentum squared of partons, ⟨ k $2\atop{⊥}$⟩, as a function of x Bj and Q 2 in a leading order QCD parton model.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Graph Learning in Physical-informed Mesh-reduced Space for Real-world Dynamic Systems

This Git repository contains codes for the 'Graph Learning in Physical-informed Mesh-reduced Space for Real-world Dynamic Systems' paper that will be published in 2023 SIGKDD. This work uses physical-informed prior (PiP) information to learn and predict fluid dynamics in a reduced mesh space. We propose a two-stage graph-based model for fluid velocity field reconstruction and prediction. In the first stage, we learn a subgraph autoencoder to summarize the information in a mesh-reduced space using physical-informed priors. In the second stage, we learn a dynamics predictor to predict subgraph evolution. We demonstrate the effectiveness of our model on two fluid flow datasets: lid-driven cavity flow data and cylinder flow data. This code is also applicable for any other dynamic systems with corresponding data.

Lei, Bo↗

Fusion Neutron Generator

The proposed code, named FROG (Fusion neutron Generator) is built upon the open-source particle transport Monte Carlo toolkit Geant4. Geant4 provides C++ classes that can be leveraged to build application-specific codes dealing with the transport of particles through matter. Geant4-based codes are applied in high-energy particle physics experiments, medical applications, shielding, and space applications for example. The FROG code allows the user to define the geometry of a neutron converter device shaped as a hollow cylinder, where a neutron breeding material such as lithium deuteride (LiD) is cladded by two concentric cylinders. Such neutron converter is then placed inside a regular nuclear fission reactor, where thermal neutrons will react with the neutron breeder material (typically, Lithium 6), and through a series of reactions, will generate high-energy neutrons – neutrons whose kinetic energy are around 14 MeV. The hollowed central portion can hold a specimen that will be bombarded by high-energy neutrons created inside the neutron breeding material. Figuratively speaking, this type of device transforms neutrons from thermal (~0.625 eV) to fusion (~14 MeV) energies and is sometimes termed “fusion-to-thermal neutron converters” in the literature. The code consists of C++ source file compiled and linked to generate an executable. The user can select the dimensions of the converter (radius, length, and thickness of the breeder material), the breeder material type, the cladding material, and the specimen material that will be activated or irradiated. As input, the neutron flux for a specific location inside a reactor, for instance, positions in ATR, is required. As output, the code predicts the number of high-energy neutrons produced, the total neutron flux and fluence as well as its detailed spectrum. The physics involved in such device is very complex, as it requires modeling neutron transport, light-ion (tritons) transport, as well as fusion reactions. The Geant4 toolkit provides the required physical models.

Martin, NicholasP. [Idaho National Laboratory (INL↗

The crystal structures of the tri-functional Chloroflexus aurantiacus and bi-functional Rhodobacter sphaeroides malyl-CoA lyases and comparison with CitE-like superfamily enzymes and malate synthases

Background: Malyl-CoA lyase (MCL) is a promiscuous carbon-carbon bond lyase that catalyzes the reversible cleavage of structurally related Coenzyme A (CoA) thioesters. This enzyme plays a crucial, multifunctional role in the 3- hydroxypropionate bi-cycle for autotrophic CO2 fixation in Chloroflexus aurantiacus. A second, phylogenetically distinct MCL from Rhodobacter sphaeroides is involved in the ethylmalonyl-CoA pathway for acetate assimilation. Both MCLs belong to the large superfamily of CitE-like enzymes, which includes the name-giving β-subunit of citrate lyase (CitE), malyl-CoA thioesterases and other enzymes of unknown physiological function. The CitE-like enzyme superfamily also bears sequence and structural resemblance to the malate synthases. All of these different enzymes share highly conserved catalytic residues, although they catalyze distinctly different reactions: C-C bond formation and cleavage, thioester hydrolysis, or both (the malate synthases). Results: Here we report the first crystal structures of MCLs from two different phylogenetic subgroups in apo- and substrate-bound forms. Both the C. aurantiacus and the R. sphaeroides MCL contain elaborations on the canonical β8/α8 TIM barrel fold and form hexameric assemblies. Upon ligand binding, changes in the C-terminal domains of the MCLs result in closing of the active site, with the C-terminal domain of one monomer forming a lid over and contributing side chains to the active site of the adjacent monomer. The distinctive features of the two MCL subgroups were compared to known structures of other CitE-like superfamily enzymes and to malate synthases, providing insight into the structural subtleties that underlie the functional versatility of these enzymes. Conclusions: Although the C. aurantiacus and the R. sphaeroides MCLs have divergent primary structures (~37% identical), their tertiary and quaternary structures are very similar. It can be assumed that the C-C bond formation catalyzed by the MCLs occurs as proposed for malate synthases. However, a comparison of the two MCL structures with known malate synthases raised the question why the MCLs are not also able to hydrolyze CoA thioester bonds. Our results suggest the previously proposed reaction mechanism for malate synthases may be incomplete or not entirely correct. Further studies involving site-directed mutagenesis based on these structures may be required to solve this puzzling question.

59 BASIC BIOLOGICAL SCIENCES↗

Laser induced deflection technique for absolute thin film absorption measurement: optimized concepts and experimental results

Using experimental results and numerical simulations, two measuring concepts of the laser induced deflection (LID) technique are introduced and optimized for absolute thin film absorption measurements from deep ultraviolet to IR wavelengths. For transparent optical coatings, a particular probe beam deflection direction allows the absorption measurement with virtually no influence of the substrate absorption, yielding improved accuracy compared to the common techniques of separating bulk and coating absorption. For high-reflection coatings, where substrate absorption contributions are negligible, a different probe beam deflection is chosen to achieve a better signal-to-noise ratio. Various experimental results for the two different measurement concepts are presented.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Afterpulse correction for micro-pulse lidar to improve middle and upper tropospheric aerosol measurements

Micro-pulse lidar (MPL) measurements have been widely used in atmospheric research over the past few decades. However, the MPL afterpulse noise has a large impact on the MPL aerosol measurement in the middle and upper troposphere, and an effective correction method is still lacking. Here, a new afterpulse correction approach is presented by using measurements with low-level optically thick clouds to act as the lids blocking atmospheric signals beyond the clouds completely. Examples are provided to illustrate the effectiveness of this correction method. Using one-year 2014 MPL measurements at the U.S. Department of Energy Atmospheric Radiation Measurement (ARM) North Slope of Alaska (NSA) site, the impact of the correction on the aerosol measurements is quantified. The relative error (RE, %) of attenuated backscattering ratio (ABR) without the afterpulse correction is 30% and 190% at the height of 1.00 km and 9.00 km (AGL), and the RE is larger for weaker aerosol signals (ABR<2). The RE of linear depolarization ratio (LDR), which is significantly higher than that of ABR for a given aerosol layer, is highly non-linear above 3.00 km, with a value of 300%-900% for weak aerosols (ABR<2) above 3.00 km. Therefore, the afterpulse correction is critical for the middle and upper tropospheric aerosol observations. We demonstrated that our afterpulse correction can provide reasonable particle depolarization ratio (PDR) to properly identify dust aerosols. The newly developed method can be applied to long-term MPL measurements to support aerosol and mixed-phase/ice cloud interaction study at the NSA site.

54 ENVIRONMENTAL SCIENCES↗

Kinetic and Spectroscopic Studies of Bicupin Oxalate Oxidase and Putative Active Site Mutants

Ceriporiopsis subvermispora oxalate oxidase (CsOxOx) is the first bicupin enzyme identified that catalyzes manganesedependent oxidation of oxalate. In previous work, we have shown that the dominant contribution to catalysis comes from the monoprotonated form of oxalate binding to a form of the enzyme in which an active site carboxylic acid residue must be unprotonated. CsOxOx shares greatest sequence homology with bicupin microbial oxalate decarboxylases (OxDC) and the 241-244DASN region of the N-terminal Mn binding domain of CsOxOx is analogous to the lid region of OxDC that has been shown to determine reaction specificity. We have prepared a series of CsOxOx mutants to probe this region and to identify the carboxylate residue implicated in catalysis. The pH profile of the D241A CsOxOx mutant suggests that the protonation state of aspartic acid 241 is mechanistically significant and that catalysis takes place at the N-terminal Mn binding site. The observation that the D241S CsOxOx mutation eliminates Mn binding to both the N- and C- terminal Mn binding sites suggests that both sites must be intact for Mn incorporation into either site. The introduction of a proton donor into the N-terminal Mn binding site (CsOxOx A242E mutant) does not affect reaction specificity. Mutation of conserved arginine residues further support that catalysis takes place at the N-terminal Mn binding site and that both sites must be intact for Mn incorporation into either site.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Does Plant Biomass Manipulation in Static Chambers Affect Nitrous Oxide Emissions from Soils?

One of the most widespread approaches for measurement of greenhouse gas emissions from soils involves the use of static chambers. This method is relatively inexpensive, is easily replicated, and is ideally suited to plot-based experimental systems. Among its limitations is the loss of detection sensitivity with increasing chamber height, which creates challenges for deployment in systems including tall vegetation. It is not always possible to avoid inclusion of plants within chambers or to extend chamber height to fully accommodate plant growth. Thus, in many systems, such as perennial forages and biomass crops, plants growing within static chambers must either be trimmed or folded during lid closure. Currently, data on how different types of biomass manipulation affect measured results is limited. For this study, we compare the effects of cutting vs. folding of biomass on nitrous oxide measurements in switchgrass (Panicum virgatum L.) and alfalfa (Medicago sativa L.) systems. We report only limited evidence of treatment effects during discrete sampling events and little basis for concern that effects may intensify over time as biomass manipulation is repeatedly imposed. However, nonsignificant treatment effects that were consistently present amounted to significant overall trends in three out of the four systems studied. Such minor disparities in flux could amount to considerable quantities over time, suggesting that caution should be exercised when comparing cumulative emission values from studies using different biomass manipulation strategies.

54 ENVIRONMENTAL SCIENCES↗

9977 type b packaging internal data collection feasibility testing - magnetic field communications

The objective of this report is to document the findings from proof-of-concept testing performed by the Savannah River National Laboratory (SRNL) R&D Engineering and Visible Assets, Inc. for the DOE Packaging Certification Program (PCP) to determine if RuBee (IEEE 1902.1) tags and readers could be used to provide a communication link from within a drum-style DOE certified Type B radioactive materials packaging. A Model 9977 Type B Packaging was used to test the read/write capability and range performance of a RuBee tag and reader. Testing was performed with the RuBee tags placed in various locations inside the packaging including inside the drum on the outside of the lid of the containment vessel and also inside of the containment vessel. This report documents the test methods and results. A path forward will also be recommended.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

On the Alpha Radiation Damage to the O-Ring Seal of the SAVY-4000 Container

In this memo, the dose to an O-ring from the alpha decay of 238 PuO 2 is calculated. These calculations were made in order to assess possible radiation damage to the O-ring, which could lead to failure and loss of integrity of the seal created by the O-ring. The O-ring being discussed here provides the seal between the lid and bottom of a nuclear materials container. The container will be used for the storage and transport of a number of different radioactive materials. The analysis is made using 238 PuO 2 as it would create the greatest damage to the O-ring when considering the materials that may be stored in it. Contamination of the O-ring is not expected to occur. But in the event radioactive material comes in contact with the O-ring, these calculations provide an estimate of the radiation damage.

07 ISOTOPE AND RADIATION SOURCES↗

Analysis of dose rates to O-ring and membrane for SAVY-4000 container

New generation standard nuclear material containers (NG SNMC aka SAVY 4000) have been designed for storage of various actinide materials whose specific activity is less than or equal to that of heat source plutonium (13.4 Ci/g). The containers also have a limiting decay heat of 25 W. The objective of this analysis is to determine the maximum absorbed dose rate delivered to the Viton o-ring and to the Teflon filter membrane located in the container’s lid under these activity and decay heat constraints. Previous analysis conducted in 2011 showed that the dose rate to the o-ring is higher for the 1-Quart container as compared to the 3-Quart container for the maximum material loading at the density of 3 g cm -3 for all material compositions studied given the size constraints of each container. Ratios of dose rates to the o-ring for the 1-Quart container as compared to the 3-Quart container are summarized in Table 1. In addition, the dose rate to the Teflon filter membrane is 3.4 times higher for the 1-Quart container with MT52+Am as compared to the 3-Quart container with MT52+Am. Thus only the 1-Quart container is analyzed in this report.

61 RADIATION PROTECTION AND DOSIMETRY↗

Critical Configuration and Physics Measurements for Beryllium Reflected Assemblies of U(93.15)O 2 Fuel Rods (1.506-cm Pitch)

Cadmium ratios were measured with enriched uranium metal foils at various locations in the assembly with the fuel tube at the 1.506-cm spacing. They are described in the following subsections. The experiment configuration was the same as the first critical configuration described in HEU-COMP-FAST-004 (Case 1). The experimenter placed 0.75-cm-diameter × 0.010-cm-thick 93.15%-235U-enriched uranium metal foils with and without 0.051-cm-thick cadmium covers at various locations in the core and top reflector. One part of the cadmium cover was cupshape and contained the uranium foil. The other part was a lid that fit over the exposed side of the foil when it was in the cup shaped section of the cover. As can be seen in the logbook, two runs were required to obtain all the measurements necessary for the cadmium ratio. The bare foil measurements within the top reflector were run first as part of the axial foil activation measurements. The results of this run are used for both the axial activation results and the cadmium ratios. Cadmium covered foils were then placed at the same location through the top reflector in a different run. Three pairs of bare and cadmium covered foils were also placed through the core tank. One pair was placed at the axial center of a fuel tube 11.35 cm from the center of the core. Two pairs of foils were placed on top of fuel tubes 3.02 and 12.06 cm from the center of the core. The activation of the uranium metal foils was measured after removal from the assembly using two lead shielded NaI scintillation detectors as follows. The NaI scintillators were carefully matched and had detection efficiencies for counting delayed-fission-product gamma rays with energies above 250 KeV within 5%. In all foil activation measurements, one foil at a specific location was used as a normalizing foil to remove the effects of the decay of fission products during the counting measurements with the NaI detectors. The normalization foil was placed on one NaI scintillator and the other foil on the other NaI detector and the activities measured simultaneously. The activation of a particular foil was compared to that of the normalization foil by dividing the count rate for each foil by that of the normalization foil. To correct for the differing efficiencies of the two NaI detectors, the normalization foil was counted in Detector 1 simultaneously with the foil at position x in Detector 2, and then the normalization foil was counted simultaneously in Detector 2 with the foil from position x in Counter 1. The activity of the foil from position x was divided by the activity of the normalization foil counted simultaneously. This resulted in obtaining two values of the ratio that were then averaged. This procedure essentially removed the effect of the differing efficiencies of the two NaI detectors. Differing efficiencies of 10% resulted in errors in the ratios measured to less than 1%. The background counting rates obatined with the foils used for the measurements on the NaI detectors before their irradiation measurement were subtracted from all count rates. The results of the cadmium ratio measurements are given in Table 1.3-1 and Figure 1.3-1. “No correction has been made for self shielding in the foils” (Reference 3).

1.506-cm pitch↗

Viability of Existing INL Facilities for Dry Storage Cask Handling

This report evaluates existing capabilities at the INL to determine if a practical and cost effective method could be developed for opening and handling full-sized dry storage casks. The Idaho Nuclear Technology and Engineering Center (INTEC) CPP-603, Irradiated Spent Fuel Storage Facility, provides the infrastructure to support handling and examining casks and their contents. Based on a reasonable set of assumptions, it is possible to receive, open, inspect, remove samples, close, and reseal large bolted-lid dry storage casks at the INL. The capability can also be used to open and inspect casks that were last examined at the TAN Hot Shop over ten years ago. The Castor V/21 and REA-2023 casks can provide additional confirmatory information regarding the extended performance of low-burnup (<45 GWD/MTU) used nuclear fuel. Once a dry storage cask is opened inside CPP-603, used fuel retrieved from the cask can be packaged in a shipping cask, and sent to a laboratory for testing. Testing at the INL’s Materials and Fuels Complex (MFC) can occur starting with shipment of samples from CPP-603 over an on-site road, avoiding the need to use public highways. This reduces cost and reduces the risk to the public. The full suite of characterization methods needed to establish the condition of the fuel exists and MFC. Many other testing capabilities also exist at MFC, but when those capabilities are not adequate, samples can be prepared and shipped to other laboratories for testing. This report discusses how the casks would be handled, what work needs to be done to ready the facilities/capabilities, and what the work will cost.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Large-Scale Molecular Dynamics Simulations of Shock Induced Plasticity in Tantalum Single Crystals

We report on large-scale non-equilibrium molecular dynamics (NEMD) simulations of shock wave compression in Ta single crystals. The atomic interactions are modeled via a recently developed and optimized embedded-atom method (EAM) potential for Ta, which reproduces the equation of state up to 200 GPa. We examined the elastic-plastic transition and shock wave structure for wave propagation along the low index directions: (100), (110) and (Ill). Shock waves along (100) and (Ill) exhibit an elastic precursor followed by a plastic wave for particle velocities below 1.1 kmls for (100) and 1.4 km/s for (Ill). The nature of the plastic deformation along (lID) is dominated by twin ning for pressures above 41 GPa.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Developing highly scalable fluid solvers for enabling multiphysics simulation.

We performed an investigation into explicit algorithms for the simulation of incompressible flows using methods with a finite, but small amount of compressibility added. Such methods include the artificial compressibility method and the lattice-Boltzmann method. The impetus for investigating such techniques stems from the increasing use of parallel computation at all levels (processors, clusters, and graphics processing units). Explicit algorithms have the potential to leverage these resources. In our investigation, a new form of artificial compressibility was derived. This method, referred to as the Entropically Damped Artificial Compressibility (EDAC) method, demonstrated superior results to traditional artificial compressibility methods by damping the numerical acoustic waves associated with these methods. Performance nearing that of the lattice- Boltzmann technique was observed, without the requirement of recasting the problem in terms of particle distribution functions; continuum variables may be used. Several example problems were investigated using a finite-di erence and finite-element discretizations of the EDAC equations. Example problems included lid-driven cavity flow, a convecting Taylor-Green vortex, a doubly periodic shear layer, freely decaying turbulence, and flow over a square cylinder. Additionally, a scalability study was performed using in excess of one million processing cores. Explicit methods were found to have desirable scaling properties; however, some robustness and general applicability issues remained.

Clausen, Jonathan R↗