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At least 1,225 records · Page 68

Ultrasonic Nondestructive Evaluation Techniques Applied to the Quantitative Characterization of Textile Composite Materials

In this Progress Report, we describe our further development of advanced ultrasonic nondestructive evaluation methods applied to the characterization of anisotropic materials. We present images obtained from experimental measurements of ultrasonic diffraction patterns transmitted through water only and transmitted through water and a thin woven composite. All images of diffraction patterns have been included on the accompanying CD-ROM in the JPEG format and Adobe TM Portable Document Format (PDF), in addition to the inclusion of hardcopies of the images contained in this report. In our previous semi-annual Progress Report (NAG 1-1848, December, 1996), we proposed a simple model to simulate the effect of a thin woven composite on an insonifying ultrasonic pressure field. This initial approach provided an avenue to begin development of a robust measurement method for nondestructive evaluation of anisotropic materials. In this Progress Report, we extend that work by performing experimental measurements on a single layer of a five-harness biaxial woven composite to investigate how a thin, yet architecturally complex, material interacts with the insonifying ultrasonic field. In Section 2 of this Progress Report we describe the experimental arrangement and methods for data acquisition of the ultrasonic diffraction patterns upon transmission through a thin woven composite. We also briefly describe the thin composite specimen investigated. Section 3 details the analysis of the experimental data followed by the experimental results in Section 4. Finally, a discussion of the observations and conclusions is found in Section 5.

Miller, James G.↗

Extension of Hopfield’s Electron Transfer Model To Accommodate Site–Site Correlation

Extension of the Förster analogue for the ET rate constant (based on virtual intermediate electron detachment or attachment states) with inclusion of site–site correlation due to coulomb terms associated with solvent reorganization energy and the driving force, has been developed and illustrated for a simple three-state, two-mode model. Furthermore, the model is applicable to charge separation (CS), recombination (CR), and shift (CSh) ET processes, with or without an intervening bridge. The model provides a unified perspective on the role of virtual intermediate states in accounting for the thermal Franck–Condon weighted density of states (FCWD), the gaps controlling superexchange coupling, and mean absolute redox potentials, with full accommodation of site–site coulomb interactions. We analyzed two types of correlation: aside from the site–site correlation due to coulomb interactions, we have emphasized the intrinsic “nonorthogonality” which generally pertains to reaction coordinates (RCs) for different ET processes involving multiple electronic states, as may be expressed by suitably defined direction cosines (cos(θ)). A pair of RCs may be nonorthogonal even when the site–site coulomb correlations are absent. While different RCs are linearly independent in the mathematical sense for all θ ≠ 0°, they are independent in the sense of being “uncorrelated” only in the limit of orthogonality (θ = 90°). There is application to more than two coordinates is straightforward and may include both discrete and continuum contributions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

First Measurement of Λ Electroproduction off Nuclei in the Current and Target Fragmentation Regions

Here, we report results of Λ hyperon production in semi-inclusive deep-inelastic scattering off deuterium, carbon, iron, and lead targets obtained with the CLAS detector and the Continuous Electron Beam Accelerator Facility 5.014 GeV electron beam. These results represent the first measurements of the Λ multiplicity ratio and transverse momentum broadening as a function of the energy fraction (z) in the current and target fragmentation regions. The multiplicity ratio exhibits a strong suppression at high z and an enhancement at low z. The measured transverse momentum broadening is an order of magnitude greater than that seen for light mesons. This indicates that the propagating entity interacts very strongly with the nuclear medium, which suggests that propagation of diquark configurations in the nuclear medium takes place at least part of the time, even at high z. The trends of these results are qualitatively described by the Giessen Boltzmann-Uehling-Uhlenbeck transport model, particularly for the multiplicity ratios. These observations will potentially open a new era of studies of the structure of the nucleon as well as of strange baryons.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Modeling the impact of liana infestation on the demography and carbon cycle of tropical forests

There is mounting empirical evidence that lianas affect the carbon cycle of tropical forests. However, no single vegetation model takes into account this growth form, although such efforts could greatly improve the predictions of carbon dynamics in tropical forests. In this study, we incorporated a novel mechanistic representation of lianas in a dynamic global vegetation model (the Ecosystem Demography Model). We developed a liana-specific plant functional type and mechanisms representing liana-tree interactions (such as light competition, liana-specific allometries, and attachment to host trees) and parameterized them according to a comprehensive literature meta-analysis. We tested the model for an old-growth forest (Paracou, French Guiana) and a secondary forest (Gigante Peninsula, Panama). The resulting model simulations captured many features of the two forests characterized by different levels of liana infestation as revealed by a systematic comparison of the model outputs with empirical data, including local census data from forest inventories, eddy flux tower data, and terrestrial laser scanner-derived forest vertical structure. The inclusion of lianas in the simulations reduced the secondary forest net productivity by up to 0.46 t C ha -1 year -1 , which corresponds to a limited relative reduction of 2.6% in comparison with a reference simulation without lianas. However, this resulted in significantly reduced accumulated above-ground biomass after 70 years of regrowth by up to 20 t C /ha (19% of the reference simulation). Ultimately, the simulated negative impact of lianas on the total biomass was almost completely cancelled out when the forest reached an old-growth successional stage. Our findings suggest that lianas negatively influence the forest potential carbon sink strength, especially for young, disturbed, liana-rich sites. In light of the critical role that lianas play in the profound changes currently experienced by tropical forests, this new model provides a robust numerical tool to forecast the impact of lianas on tropical forest carbon sinks.

59 BASIC BIOLOGICAL SCIENCES↗

Heavy ion fragmentation experiments at the bevatron

Collaborative research efforts to study the fragmentation processes of heavy nuclei in matter using heavy ion beams of the Bevatron/Bevalac are described. The goal of the program is to obtain the single particle inclusive spectra of secondary nuclei produced at 0 deg by the fragmentation of heavy ion beam projectiles. The process being examined is B+T yields F + anything, where B is the beam nucleus, T is the target nucleus, and F is the detected fragment. The fragments F are isotopically identified by experimental procedures involving magnetic analysis, energy loss and time-of-flight measurements. Effects were also made to: (a) study processes of heavy nuclei in matter, (b) measure the total and partial production cross section for all isotopes, (c) test the applicability of high energy multiparticle interaction theory to nuclear fragmentation, (d) apply the cross section data and fragmentation probabilities to cosmic ray transport theory, and (e) search for systematic behavior of fragment production as a means to improve existing semi-empirical theories of cross-sections.

Heckman, H. H.↗

Measurement of azimuthal anisotropy of muons from charm and bottom hadrons in Pb+Pb collisions at $\sqrt{s_{NN}}$ = 5.02 TeV with the ATLAS detector

Azimuthal anisotropies of muons from charm and bottom hadron decays are measured in Pb+Pb collisions at s NN = 5.02 TeV . The data were collected with the ATLAS detector at the Large Hadron Collider in 2015 and 2018 with integrated luminosities of 0.5 nb - 1 and 1.4 n b - 1 , respectively. The kinematic selection for heavy-flavor muons requires transverse momentum 4 <lt; p T < 30 GeV and pseudorapidity | η | < 2.0 . The dominant sources of muons in this p T range are semi-leptonic decays of charm and bottom hadrons. These heavy-flavor muons are separated from light-hadron decay muons and punch-through hadrons using the momentum imbalance between the measurements in the tracking detector and in the muon spectrometers. Azimuthal anisotropies, quantified by flow coefficients, are measured via the event-plane method for inclusive heavy-flavor muons as a function of the muon p T and in intervals of Pb+Pb collision centrality. Heavy-flavor muons are separated into contributions from charm and bottom hadron decays using the muon transverse impact parameter with respect to the event primary vertex. Non-zero elliptic ( v 2 ) and triangular ( v 3 ) flow coefficients are extracted for charm and bottom muons, with the charm muon coefficients larger than those for bottom muons for all Pb+Pb collision centralities. The results indicate substantial modification to the charm and bottom quark angular distributions through interactions in the quark-gluon plasma produced in these Pb+Pb collisions, with smaller modifications for the bottom quarks as expected theoretically due to their larger mass.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Inclusive neutrino scattering off deuteron from threshold to GeV energies

Cross sections for inclusive neutrino scattering off deuteron induced by neutral and charge-changing weak currents are calculated from threshold up to GeV energies, using the Argonne v{sub 18} potential and consistent nuclear electroweak currents with one- and two-body terms. Two-body contributions are found to be small, and increase the cross sections obtained with one-body currents by less than 10% over the whole range of energies. Total cross sections obtained by describing the final two-nucleon states with plane waves differ negligibly, for neutrino energies {approx}> 500 MeV, from those in which interaction effects in these states are fully accounted for. The sensitivity of the calculated cross sections to different models for the two-nucleon potential and/or two-body terms in the weak current is found to be weak. In order to illustrate nuclear structure effects, the cross sections are compared to those obtained in a naive model in which the deuteron is taken to consist of a free proton and neutron at rest.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Some design philosophy for reducing the community noise of advanced counter-rotation propellers

Advanced counter-rotation propellers have been indicated as possibly generating an unacceptable amount of noise for the people living near an airport. This report has explored ways to reduce this noise level, which is treated as being caused by the interaction of the upstream propeller wakes and vortices with the downstream propeller. The noise reduction techniques fall into two categories: (1) reducing the strength of the wakes and vortices, and (2) reducing the response of the downstream blades to them. The noise from the wake interaction was indicated as being reduced by increased propeller spacing and decreased blade drag coefficient. The vortex-interaction noise could be eliminated by having the vortex pass over the tips of the downstream blade, and it could be reduced by increased spacing or decreased initial circulation. The downstream blade response could be lessened by increasing the reduced frequency parameter omega or by phasing of the response from different sections to have a mutual cancellation effect. Uneven blade to blade spacing for the downstream blading was indicated as having a possible effect on the annoyance of counter-rotation propeller noise. Although there are undoubtedly additional methods of noise reduction not covered in this report, the inclusion of the design methods discussed would potentially result in a counter-rotation propeller that is acceptably quiet.

Dittmar, J. H.↗

Some aspects of the interaction between chemical and dynamic processes relating to the Antarctic ozone hole

Observational and modeling studies have been conducted to examine the interaction between the chemical and dynamical processes that occur during springtime in the lower stratosphere of the Southern Hemisphere. The temporal evolution of the ozone distribution and the circulation during 1987 is contrasted with that for 1988 as an illustrative example of how dynamical processes and the resulting meteorological conditions modulate the ozone depletion. Concurrently with the observational analysis, an effort was initiated to simulate the ozone depletion during austral spring using a 3D chemical/transport model. The model includes a parameterized representation of the heterogeneous processes thought to be important in this region. The simulation indicates that the inclusion of this additional chemistry, which results in the release of free chlorine and the redistribution of odd nitrogen into reservoir species, reproduces many aspects of the observations.

Eckman, R. S.↗

First observation of isolated nuclear recoils following neutron capture for dark matter calibration

Low-energy nuclear recoils (NRs) are hard to measure, because they produce few e - /h + pairs in solids—i.e., they have low “ionization yield.” A silicon detector was exposed to thermal neutrons over 2.5 live days, probing NRs down to 450 eV. The observation of a neutron capture-induced component of NRs at low energies is supported by the much-improved fit upon inclusion of a capture NR model. This result shows that thermal neutron calibration of very low recoil energy NRs is promising for dark matter searches, coherent neutrino experiments, and improving understanding of ionization dynamics in solids.

79 ASTRONOMY AND ASTROPHYSICS↗

Volcanic forcing degrades multiyear-to-decadal prediction skill in the tropical Pacific

Volcanic aerosol forcing can affect global climate, but its role in climate prediction remains poorly understood. We isolate the impact of volcanic eruptions on multiyear-to-decadal climate prediction skill by comparing two suites of initialized decadal hindcasts conducted with and without historical volcanic forcing. Unexpectedly, the inclusion of volcanic forcing in the prediction system significantly degrades the forecast skill of detrended multiyear-to-decadal sea surface temperature (SST) variability in the central-eastern tropical Pacific. The ensemble mean hindcasts produce multiyear-to-decadal tropical Pacific SST cooling in response to large tropical volcanic eruptions through thermodynamic and El Niño–Southern Oscillation (ENSO)–like dynamic processes. However, in observations, these eruptions coincided with tropical Pacific warming, which is well predicted by the no-volcano hindcasts and, hence, is likely related to internal climate variability. Improved model representation of volcanic response and its interaction with internal climate variability is required to advance prediction of tropical Pacific decadal variability and associated global impacts.

54 ENVIRONMENTAL SCIENCES↗

An Investigation into the Influence of Filler Piper nigrum Leaves Extract on Physicochemical and Antimicrobial Properties of Chitosan/Poly (Vinyl Alcohol) Blend Films

The influence of Piper nigrum (P. nigrum) leaves extract on structural and physicochemical properties of chitosan/poly (vinyl alcohol) (CH/PVA) blend films were studied. The hypothesis of the study was confirmed by using UTM, SEM, AFM, TGA, DSC, XRD, and FTIR studies. Interestingly, increased mechanical properties were observed with inclusion of P. nigrum leaves extract to the CH/PVA blend films. SEM micrographs revealed that there is a smooth homogeneous phase morphology with better compatibility. The results of X-ray diffraction study confirmed that influence of crystallinity on mechanical properties of the blend films. Further, the results of TGA witnessed that addition of P. nigrum leaves extract did not influence much on thermal stability of the CH/PVA blend films. The presence of a single glass transition temperature (T{sub g}) indicated that complete miscibility among the blend components. The result of FTIR study confirmed the presence of a significant interaction among the chitosan, PVA and P. nigrum leaves extract. The water contact angle measurement and the antimicrobial study revealed that CH/PVA/P. nigrum leaves extract blend films showed decreased hydrophobicity and enhanced antimicrobial activity. Hence, this partly stimulated research data obtained from the study might be an advantage for new packaging material preparations in the future.

36 MATERIALS SCIENCE↗

Electronic structure theory on modeling short-range noncovalent interactions between amino acids

While short-range noncovalent interactions (NCIs) are proving to be of importance in many chemical and biological systems, these atypical bindings happen within the so-called van der Waals envelope and pose an enormous challenge for current computational methods. We introduce SNCIAA, a database of 723 benchmark interaction energies of short-range noncovalent interactions between neutral/charged amino acids originated from protein x-ray crystal structures at the “gold standard” coupled-cluster with singles, doubles, and perturbative triples/complete basis set [CCSD(T)/CBS] level of theory with a mean absolute binding uncertainty less than 0.1 kcal/mol. Subsequently, a systematic assessment of commonly used computational methods, such as the second-order Møller−Plesset theory (MP2), density functional theory (DFT), symmetry-adapted perturbation theory (SAPT), composite electronic-structure methods, semiempirical approaches, and the physical-based potentials with machine learning (IPML) on SNCIAA is carried out. It is shown that the inclusion of dispersion corrections is essential even though these dimers are dominated by electrostatics, such as hydrogen bondings and salt bridges. Overall, MP2, ωB97M-V, and B3LYP+D4 turned out to be the most reliable methods for the description of short-range NCIs even in strongly attractive/repulsive complexes. SAPT is also recommended in describing short-range NCIs only if the δMP2 correction has been included. The good performance of IPML for dimers at close-equilibrium and long-range conditions is not transferable to the short-range. We expect that SNCIAA will assist the development/improvement/validation of computational methods, such as DFT, force-fields, and ML models, in describing NCIs across entire potential energy surfaces (short-, intermediate-, and long-range NCIs) on the same footing.

Chemistry↗

Ab initio many-body calculations of nucleon- 4 He scattering with three-nucleon forces

We extend the ab initio no-core shell model/resonating-group method to include three-nucleon (3N) interactions for the description of nucleon-nucleus collisions. We outline the formalism, give algebraic expressions for the 3N-force integration kernels, and discuss computational aspects of two alternative implementations. The extended theoretical framework is then applied to nucleon- 4 He elastic scattering using similarity-renormalization-group (SRG)-evolved nucleon-nucleon plus 3N potentials derived from chiral effective field theory. We analyze the convergence properties of the calculated phase shifts and explore their dependence upon the SRG evolution parameter. We include up to six excited states of the 4 He target and find significant effects from the inclusion of the chiral 3N force, e.g., it enhances the spin-orbit splitting between the 3/2 – and 1/2 – resonances and leads to an improved agreement with the phase shifts obtained from an accurate R-matrix analysis of the five-nucleon experimental data. As a result, we find remarkably good agreement with measured differential cross sections at various energies below the d+ 3 H threshold, while analyzing powers manifest larger deviations from experiment for certain energies and angles.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Application of a folding-model optical potential to analyzing inelastic pion–nucleus scattering and the in-medium effect on a pion–nucleon amplitude

The folding-model optical potential is generalized in such a way as to apply it to calculating the cross sections for inelastic scattering of π{sup ±}-mesons on {sup 28}Si, {sup 40}Ca, {sup 58}Ni, and {sup 208}Pb nuclei at the energies of 162, 180, 226, and 291 MeV leading to the excitation of the 2{sup +} and 3{sup −} collective states. In doing this, use is made of known nucleon-density distributions in nuclei and the pion–nucleon scattering amplitude whose parameters were obtained previously by fitting the elastic scattering cross sections for the same nuclei. Thus, the values of quadrupole (β{sub 2}) and octupole (β{sub 3}) deformations of nuclei appear here as the only adjustable parameters. The scattering cross section is calculated by solving the relativistic wave equation, whereby effects of relativization and distortion in the entrance and exit scattering channels are taken exactly into account. The cross sections calculated in this way for inelastic scattering are in good agreement with respective experimental data. The importance of the inclusion of in-medium effects in choosing parameters of the pion–nucleon amplitude is emphasized.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Measurement of prompt charged-particle production in pp collisions at $\sqrt{s}$ = 13 TeV

The differential cross-section of prompt inclusive production of long-lived charged particles in proton-proton collisions is measured using a data sample recorded by the LHCb experiment at a centre-of-mass energy of $\sqrt{s}$ = 13 TeV. The data sample, collected with an unbiased trigger, corresponds to an integrated luminosity of 5.4 nb -1 . The differential cross-section is measured as a function of transverse momentum and pseudorapidity in the ranges $p_T$ ∋ [80, 10 000) MeV/c and η ∋ [2.0, 4.8) and is determined separately for positively and negatively charged particles. The results are compared with predictions from various hadronic-interaction models.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Effective field theory approach to open heavy flavor production in heavy-ion collisions

We develop a version of Soft Collinear Effective Theory (SCET) which includes finite quark masses, as well as Glauber gluons that describe the interaction of collinear partons with QCD matter. In the framework of this new effective field theory, labeled SCET M,G , we derive the massive splitting functions in the vacuum and the QCD medium for the processes $Q → Qg, Q → gQ$ and $g→Q\bar{Q}$. The numerical effects due to finite quark masses are sizable and our results are consistent with the traditional approach to parton energy loss in the soft gluon emission limit. In addition, we present a new framework for including the medium-induced full splitting functions consistent with next-to-leading order calculations in QCD for inclusive hadron production. Finally, we show numerical results for the suppression of D- and B-mesons in heavy ion collisions at $\sqrt{s_{NN}}$=5.02 TeV and 2.76 TeV and compare to available data from the LHC.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Gerischer Electrochemistry Today

Semiconductor photoelectrochemistry is a dynamic and interdisciplinary field at the forefront of research in solar fuels, energy conversion, and catalysis. Here, this Perspective captures the collective insights from the second Gerischer Electrochemistry Today Symposium, held at Colorado State University in Fort Collins, CO, in August 2024, which convened leading researchers, early-career scientists, and industry partners to define the critical next steps for the field. Through interactive sessions, technical talks, panel discussions, and training initiatives─including a Semiconductor Electrochemistry Bootcamp─the symposium emphasized three pillars of advancement: (i) facilitating the exchange of new ideas in semiconductor electrochemistry and charge separation; (ii) fostering the development of future researchers, research topics, and participation in the semiconductor workforce; and (iii) building community. This Energy Focus distills key themes from the meeting and identifies major knowledge gaps in the following areas: mechanisms of charge separation and recombination, role of defects and disorder, dynamic and operando characterization methods, interfacial chemistry and surface passivation, theoretical and modeling limitations, and standardization and benchmarking. The inclusive and collaborative structure of the symposium enabled the generation of this comprehensive report that will serve as a roadmap for fundamental and applied research in the rapidly evolving field of semiconductor electrochemistry over the next decade.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗