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At least 469 records · Page 26

Experimental uncertainty quantification using templates of expected measurement uncertainties for fast neutron-induced total, capture, and scattering cross sections

Careful experimental uncertainty quantification (UQ) is key for developing trustworthy evaluated nuclear data. Templates to account for missing or under-reported experimental uncertainties were recently developed by the covariance committee of Cross Section Evaluation Working Group (CSEWG). In this work, we illustrate the practical application and limitations of these templates for selected neutron-induced reactions, including (n, tot), (n, γ), and (n, xn) in the fast energy range, to illustrate their use in data analyses for nuclear data evaluations. We show that while the templates provide consistent framework, proper implementation still requires detailed knowledge of experimental conditions and careful treatment of nonlinear effects in cross section derivation. Case studies highlight how template-assisted UQ improves consistency with previous evaluations such as ENDF/B and reveals open challenges in propagating uncertainties across different energy regimes. The main contribution of this paper is to connect formal template recommendations with their use in practical evaluation workflows, clarifying both their benefits and current limitations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Measurement of the total cross section from elastic scattering in pp collisions at s = 8 TeV with the ATLAS detector

A measurement of the total ppcross section at the LHC at √s=8TeV is presented. An integrated luminosity of 500 μb-1 was accumulated in a special run with high-β beam optics to measure the differential elastic cross section as a function of the Mandelstam momentum transfer variable t. The measurement is performed with the ALFA sub-detector of ATLAS. Using a fit to the differential elastic cross section in the -t range from 0.014GeV2 to 0.1GeV2 to extrapolate t→0, the total cross section, σtot(pp →X), is measured via the optical theorem to be σtot(pp→ X) = 96.07±0.18 (stat.)±0.85 (exp.)± 0.31 (extr.) mb, where the first error is statistical, the second accounts for all experimental systematic uncertainties and the last is related to uncertainties in the extrapolation t→0. In addition, the slope of the exponential function describing the elastic cross section at small t is determined to be B =19.74 ±0.05 (stat.) ±0.23 (syst.) GeV-2.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

A Vegetation Correction Methodology for Time Series Based Soil Moisture Retrieval From C-band Radar Observations

A methodology is presented to correct backscatter (sigma(sup 0)) observations for the effect of vegetation. The proposed methodology is based on the concept that the ratio of the surface scattering over the total amount of scattering (sigma(sup 0)(sub soil)/sigma(sup 0)) is only affected by the vegetation and can be described as a function of the vegetation water content. Backscatter observations sigma(sup 0) from the soil are not influenced by vegetation. Under bare soil conditions (sigma(sup 0)(sub soil)/sigma(sup 0)) equals 1. Under low to moderate biomass and soil moisture conditions, vegetation affects the observed sigma(sup 0) through absorption of the surface scattering and contribution of direct scattering by the vegetation itself. Therefore, the contribution of the surface scattering is smaller than the observed total amount of scattering and decreases as the biomass increases. For dense canopies scattering interactions between the soil surface and vegetation elements (e.g. leaves and stems) also become significant. Because these higher order scattering mechanisms are influenced by the soil surface, an increase in (sigma(sup 0)(sub soil)/sigma(sup 0)) may be observed as the biomass increases under densely vegetated conditions. This methodology is applied within the framework of time series based approach for the retrieval of soil moisture. The data set used for this investigation has been collected during a campaign conducted at USDA's Optimizing Production Inputs for Economic and Environmental Enhancement OPE-3) experimental site in Beltsville, Maryland (USA). This campaign took place during the corn growth cycle from May 10th to 0ctober 2nd, 2002. In this period the corn crops reached a vegetation water content of 5.1 kg m(exp -2) at peak biomass and a soil moisture range varying between 0.00 to 0.26 cubic cm/cubic cm. One of the deployed microwave instruments operated was a multi-frequency (C-band (4.75 GHz) and L-band (1.6 GHz)) quad-polarized (HH, HV, VV, VH) radar which was mounted on a 20 meter long boom. In the OPE-3 field campaign, radar observations were collected once a week at nominal times of 8 am, 10 am, 12 noon and 2 pm. During each data run the radar acquired sixty independent measurements within an azimuth of 120 degrees from a boom height of 12.2 m and at three different incidence angles (15,35, and 55 degrees). The sixty observations were averaged to provide one backscatter value for the study area and its accuracy is estimated to be 51.0 dB. For this investigation the C-band observations have been used. Application of the proposed methodology to the selected data set showed a well-defined relationship between (sigma(sup 0)(sub soil)/sigma(sup 0)) and the vegetation water content. It is found that this relationship can be described with two experimentally determined parameters, which depend on the sensing configuration (e.g. incidence angle and polarization). Through application of the proposed vegetation correction methodology and the obtained parameterizations, the soil moisture retrieval accuracy within the framework of a time series based approach is improved from 0.033 to 0.032 cubic cm/cubic cm, from 0.049 to 0.033 cubic cm/cubic cm and from 0.079 to 0.047 cubic cm/cubic cm for incidence angles of 15,35 and 55 degrees, respectively. Improvement in soil moisture retrieval due to vegetation correction is greater at larger incidence angles (due to the increased path length and larger vegetation effects on the surface signal at the larger angles).

Joseph, Alicia T.↗

Atomic-level structural correlations across the morphotropic phase boundary of a ferroelectric solid solution: xBiMg 1/2 Ti 1/2 O 3 -(1$-$x)PbTiO 3

Revelation of unequivocal structural information at the atomic level for complex systems is uniquely important for deeper and generic understanding of the structure property connections and a key challenge in materials science. Here in this paper we report an experimental study of the local structure by applying total elastic scattering and Raman scattering analyses to an important non-relaxor ferroelectric solid solution exhibiting the so-called composition-induced morphotropic phase boundary (MPB), where concomitant enhancement of physical properties have been detected. The powerful combination of static and dynamic structural probes enabled us to derive direct correspondence between the atomic-level structural correlations and reported properties. The atomic pair distribution functions obtained from the neutron total scattering experiments were analysed through big-box atom-modelling implementing reverse Monte Carlo method, from which distributions of magnitudes and directions of off-centred cationic displacements were extracted. We found that an enhanced randomness of the displacement-directions for all ferroelectrically active cations combined with a strong dynamical coupling between the A- and B-site cations of the perovskite structure, can explain the abrupt amplification of piezoelectric response of the system near MPB. Finally, altogether this provides a more fundamental basis in inferring structure-property connections in similar systems including important implications in designing novel and bespoke materials.

36 MATERIALS SCIENCE↗

Diffraction by Sharp Edges of Noncanonical Shape with Mean Flow and Surface Impedance

This paper presents a study on diffraction by sharp edges of noncanonical edge shape in the presence of mean flow and surface impedance, which are important features for aircraft noise but have not been accounted for in previous studies on sharp-edge diffraction. An analytical formula for the diffracted pressure is derived by applying asymptotic analysis to the integral representation of the total pressure scattered by a geometry that contains sharp edges. The asymptotic analysis is presented as a systematic process that can be carried out to any order, if needed. An illustration is given to use a higher-order result to eliminate the singularity in the first-order result to make the solution regular in the entire parameter domain. The formula for the diffracted pressure is validated by experimental data and is applied to parametric studies to reveal the effects of noncanonical edge shape, mean flow and surface impedance, as well as the impact of these effects on the total scattered pressure in the presence of other scattering components.

Yueping Guo↗

Reprobing the mechanism of negative thermal expansion in siliceous faujasite

A combination of Rietveld refinement and PDF analysis of total neutron scattering data are used to provide further insight into the negative thermal expansion mechanism of siliceous faujasite. The negative thermal expansion mechanism of siliceous faujasite is attributed to the transverse vibrations of bridging oxygen atoms resulting in the coupled librations of the SiO 4 tetrahedra. The constituent SiO 4 tetrahedra are revealed to expand in size with temperature which is a behaviour that has not been determined directly previously and they are also shown to undergo some distortion as temperature is increased. However, these distortions are not distinct enough in any geometric manner for the average behaviour of the SiO 4 tetrahedra not to be considered as that of a rigid units. The work further displays the benefits of using total scattering experiments to unveil the finer details of dynamic thermomechanical processes within crystalline materials.

36 MATERIALS SCIENCE↗

$J/\psi $-p scattering length from the total and differential photoproduction cross sections

The J/ψ-p scattering length, αJ/ψp, can be extracted from the J/ψ photoproduction cross section near threshold using the Vector Meson Dominance (VMD) model to relate the reaction γp→J/ψp to J/ψp→J/ψp. Such estimates based on experimental data result in values for |αJ/ψp|, which are much lower than most of the theoretical predictions. In this work, we study the relations between the different results, depending on the use of the total or the differential cross sections, and the method of extrapolating the data to threshold in the case of a low-statistics data sample, such as the near threshold J/ψ photoproduction dataset. We estimate a range for |αJ/ψp| of 0.003–0.025 fm as extracted from experimental data within the VMD model and discuss possible reasons for such lower values compared to the theoretical results.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

An investigation into electron scattering from pyrazine at intermediate and high energies

Total electron scattering cross sections for pyrazine in the energy range 10–500 eV have been measured with a new magnetically confined electron transmission-beam apparatus. Theoretical differential and integral elastic, as well as integral inelastic, cross sections have been calculated by means of a screening-corrected form of the independent-atom representation (IAM-SCAR) from 10 to 1000 eV incident electron energies. The present experimental and theoretical total cross sections show a good level of agreement, to within 10%, in the overlapping energy range. Consistency of these results with previous calculations (i.e., the R-matrix and Schwinger Multichannel methods) and elastic scattering measurements at lower energies, below 10 eV, is also discussed.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

SU-E-QI-03: Compartment Modeling of Dynamic Brain PET - The Effect of Scatter and Random Corrections On Parameter Errors

Purpose: To investigate the effects of corrections for random and scattered coincidences on kinetic parameters in brain tumors, by using ten Monte Carlo (MC) simulated dynamic FLT-PET brain scans. Methods: The GATE MC software was used to simulate ten repetitions of a 1 hour dynamic FLT-PET scan of a voxelized head phantom. The phantom comprised six normal head tissues, plus inserted regions for blood and tumor tissue. Different time-activity-curves (TACs) for all eight tissue types were used in the simulation and were generated in Matlab using a 2-tissue model with preset parameter values (K1,k2,k3,k4,Va,Ki). The PET data was reconstructed into 28 frames by both ordered-subset expectation maximization (OSEM) and 3D filtered back-projection (3DFBP). Five image sets were reconstructed, all with normalization and different additional corrections C (A=attenuation, R=random, S=scatter): Trues (AC), trues+randoms (ARC), trues+scatters (ASC), total counts (ARSC) and total counts (AC). Corrections for randoms and scatters were based on real random and scatter sinograms that were back-projected, blurred and then forward projected and scaled to match the real counts. Weighted non-linearleast- squares fitting of TACs from the blood and tumor regions was used to obtain parameter estimates. Results: The bias was not significantly different for trues (AC), trues+randoms (ARC), trues+scatters (ASC) and total counts (ARSC) for either 3DFBP or OSEM (p<0.05). Total counts with only AC stood out however, with an up to 160% larger bias. In general, there was no difference in bias found between 3DFBP and OSEM, except in parameter Va and Ki. Conclusion: According to our results, the methodology of correcting the PET data for randoms and scatters performed well for the dynamic images where frames have much lower counts compared to static images. Generally, no bias was introduced by the corrections and their importance was emphasized since omitting them increased bias extensively.

60 APPLIED LIFE SCIENCES↗

Total X-ray scattering and big-box modeling of pressure-induced local disorder and partial amorphization in CsPbBr 3

The mechanisms governing pressure-induced amorphization and its reversibility in halide perovskites are not yet fully understood, particularly the contribution of local disorder. We performed high-pressure synchrotron total X-ray scattering and reverse Monte Carlo (RMC) big-box modeling using CsPbBr 3 as a model system to investigate short-range structural evolution in both the ordered and partially amorphous phases. While diffraction data indicate that long-range order persists up to 2 GPa, pair distribution function (PDF) analysis reveals significant local distortions, including PbBr 6 octahedral tilting and Cs displacement, which influence the bandgap through a complex interplay between bond compression and angular tilting. Beyond 2 GPa, CsPbBr 3 undergoes partial amorphization, with significant disordering of Cs and Br, while the Pb sublattice remains preserved, allowing for structural recovery upon decompression. Our work, accounting for both short- and long-range structural evolution through RMC modeling, successfully captures how disorder shapes the structural response of halide perovskites under pressure.

critical phenomena↗

Local lattice distortions and electronic orders in strongly correlated systems by resonant total x-ray scattering: A case study of A Pt 2 X 2 intermetallics ( A = U , Ce, or La and X = Si or Ge)

Revealing local lattice distortions in physical systems is nontrivial, largely because such structural features often are not necessarily amenable to traditional crystallographic investigations. This poses limits to our understanding of the underlying physic, particularly in the case of strongly correlated systems where structural, electronic and magnetic degrees of freedom are intertwined. Using resonant total x-ray scattering coupled to differential pair distribution function analysis, we reveal the presence of pronounced local lattice distortions in the square net Pt planes in the prototypical strongly correlated APt 2 X 2 intermetallics (A = U, Ce or La and X = Si or Ge). The distortions are present before charge density wave, magnetic, Kondo lattice coherence and/or superconducting orders emerge in these materials and, as density functional calculations suggest, are likely to affect them. Finally, our study sheds light on the poorly known interactions between electronic orders and structural disorder in strongly correlated systems and also demonstrates an advanced experimental approach to determine it that is relevant to any physical system showing deviations from perfect crystallinity.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Calculation of total and ionization cross sections for electron scattering by primary benzene compounds

The total and ionization cross sections for electron scattering by benzene, halobenzenes, toluene, aniline, and phenol are reported over a wide energy domain. The multi-scattering centre spherical complex optical potential method has been employed to find the total elastic and inelastic cross sections. The total ionization cross section is estimated from total inelastic cross section using the complex scattering potential-ionization contribution method. In the present article, the first theoretical calculations for electron impact total and ionization cross section have been performed for most of the targets having numerous practical applications. A reasonable agreement is obtained compared to existing experimental observations for all the targets reported here, especially for the total cross section.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Polarimetric backscattering from sea ice

Polarimetric backscattering from sea ice is presented. Theoretical models for backscattering are first presented for various ice types. Then, theoretical results are compared with experimental data for new thin ice, first-year ice, and multi-year ice. Sea ice is modeled as a layer medium containing random scatterers and rough interfaces. For multi-year sea ice with snow cover, the sea ice layer is modeled as an ice background with embedded spheroidal air bubbles and the snow layer as air with ice grains. The hummocky topography on multi-year ice is characterized by a Gaussian distribution which has an averaging effect on backscattering coefficients. First-year sea ice is described by an ice medium hosting ellipsoidal brine inclusions. These inclusions are oriented preferentially in the vertical direction due to the columnar structure of first-year sea ice. Azimuthally, the orientation of the brine pockets are random corresponding to the random c-axes in sea ice, unless the axes are oriented by sea currents. For thin ice in newly opened leads, it has been observed that there exists a thin brine layer with very high salinity on the top surface of the new ice. This brine layer is depicted as a medium with high permittivity which can significantly affect electromagnetic scattering signatures from the lower thin ice layer, with a higher fractional volume of brine inclusions due to higher salinity as compared to thick first-year sea ice. The rough medium interfaces are described as Gaussian rough surfaces characterized by root-mean-square heights and surface correlation lengths. The contribution from rough surface, calculated under the Kirchhoff approximation or small perturbation method, is assumed to be independent from volume scattering. The total loss including absorption and scattering losses in the scattering media is represented by the imaginary part of effective permittivity obtained from the strong fluctuation theory. The polarimetric scattering coefficients for different ice types are then derived under the distorted Born approximation.

Nghiem, S. V.↗

Effect of molecular anisotropy on beam scattering measurements

Within the energy sudden approximation, the total integral and total differential scattering cross sections are given by the angle average of scattering cross sections computed at fixed rotor orientations. Using this formalism the effect of molecular anisotropy on scattering of He by HCl and by CO is examined. Comparisons with accurate close coupling calculations indicate that this approximation is quite reliable, even at very low collision energies, for both of these systems. Comparisons are also made with predictions based on the spherical average of the interaction. For HCl the anisotropy is rather weak and its main effect is a slight quenching of the oscillations in the differential cross sections relative to predictions of the spherical averaged potential. For CO the anisotropy is much stronger, so that the oscillatory pattern is strongly quenched and somewhat shifted. It appears that the sudden approximation provides a simple yet accurate method for describing the effect of molecular anisotropy on scattering measurements.

Goldflam, R.↗