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At least 955 records · Page 53

Curve crossing for low energy elastic scattering of He (plus) by Ne

The perturbation seen in the experimental differential elastic scattering cross section for the 40 eV He(+) + Ne system was attributed to a single crossing of two intermolecular potential energy curves. A new theoretical treatment of the curve crossing problem, that of Delos and Thorson, is employed to obtain the crossing probabilities and phases associated with the crossing. These are determined by utilizing ab initio potentials involved in the crossing and are further used in a partial wave calculation of the cross section, which is compared with our experiment. The origin of the oscillatory structure observed in the differential cross section is discussed in semiclassical terms by defining the problem in terms of two pseudo-deflection functions. A rainbow effect is shown to be related to a particular feature (a maximum rather than a minimum) of these deflection functions.

Bobbio, S. M.↗

The temperature structure in accretion flows onto massive protostars

Radiation transfer problems involved in the infall of dust and gas during star formation are studied. Dust properties are discussed, and modifications of spherical radiative transfer equations are presented that permit forward scattering by dust to be treated for the small size of the star relative to the inner radius of the shell. A procedure for deriving the stellar radiation field incident on the inner edge of the shell is developed. The temperature correction procedure of Cassinelli and Hartmann (1975) for extended stellar atmospheres is modified so that the multitemperature nature of the grains in the cloud may be derived. Temperature distributions for three schematic models in which the density is prespecified are discussed. Radiative acceleration of grains is addressed, showing that the proper mean opacity differs by a large factor from the Rosseland mean opacity that is commonly used. Emergent fluxes for the models are given.

Wolfire, Mark G.↗

US and foreign alloy cross-reference database

Marshall Space Flight Center and other NASA installations have a continuing requirement for materials data from other countries involved with the development of joint international Spacelab experiments and other hardware. This need includes collecting data for common alloys to ascertain composition, physical properties, specifications, and designations. This data is scattered throughout a large number of specification statements, standards, handbooks, and other technical literature which make a manual search both tedious and often limited in extent. In recognition of this problem, a computerized database of information on alloys was developed along with the software necessary to provide the desired functions to access this data. The intention was to produce an initial database covering aluminum alloys, along with the program to provide a user-interface to the data, and then later to extend and refine the database to include other nonferrous and ferrous alloys.

Springer, John M.↗

Challenges in Physics of Biocrystals and Biocrystallization

Selected problems in biocrystal mechanics(1), nucleation(2) and growth(3) will be addressed. (1) Elastic moduli of protein crystals found from triple bonding, rod vibrations, ultrasound speed and Brillion light scattering vary in a wide range of 0.3 - 3 GPa. This diversity comes from behaviour of intracrystalline liquid. Namely, liquid flow through the narrow intermolecular channels between compressed and expanded regions within an inhomogeneously deformed crystal was considered. The deformation comes from bending or ultrasound wave propagation. (2) Wide scattering in the number of crystals nucleated in the batch technique may come from liquid flow turbulence associated with pipetting; the Reynolds number these injections reaches 10(exp 3). (3) Poor reproducibility in crystal size and, probably, perfection is supposed to come from a variety of growth conditions in the same batch. Growth in a kinetic growth mode in laminar flow, e.g., in a microfluidic device, would allow to better understand growth kinetics and defect formation.

Chernov, Alexander A.↗

Comment on “Anisotropic Scattering Caused by Apical Oxygen Vacancies in Thin Films of Overdoped High-Temperature Cuprate Superconductors”

The comment is on the article published in Vol. 128, Iss. 13 — 1 April 2022, https://journals.aps.org/prl/abstract/10.1103/PhysRevLett.128.137001. In Ref. 1, Wang et al. address an important problem in the overdoped cuprates, taking the first steps toward understanding the structure of real defects in these materials, in this case the apical oxygen vacancy, VO, that sits immediately above the planar Cu. However, the approach taken has some issues, which we outline in this Comment

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Countercations Control Local Specific Bonding Interactions and Nucleation Mechanisms in Concentrated Water-in-Salt Solutions

One of the continuing challenges presented in aqueous salt solutions is to understand ion association reactions driving dynamic demixing from solvation, complexation and solute clustering. The problems understanding this phenomenon are exacerbated in the highly-concentrated water-in-salt electrolytes, where the deficiency of water leads to a dramatic retardation of solvating water and formation of extended solvent-solute clustering networks. By probing microscopic dynamics of water and prenucleation clusters using quasi-elastic neutron scattering and proton nuclear magnetic resonance spectroscopy, we observed contrasting mechanistic specifics of ion-water mobilities in highly-concentrated Na+- vs. K+-based aluminate solutions (diffusion coefficients of 0.2 vs. 2.6?10-10m2s-1 at 293 K, respectively). The magnitude of the differences is far beyond the kosmotropic (Na+) and chaotropic (K+) effects typically understood at low ionic concentrations. The distinct crystallization mechanisms observed in analogous deuterated systems further imply that different prenucleation cluster dynamics and network packing morphologies can either frustrate or promote crystallization, as described by non-classical nucleation theory.

Wang, Hsiu-Wen↗

Variational Monte Carlo calculations of n + H 3 scattering

A paramount goal in nuclear physics is to unify ab initio treatments of bound and unbound states. The position-space quantum Monte Carlo (QMC) methods have a long history of successful bound-state calculations in light systems but have seen minimal implementation in unbound systems. Here, we introduce a numerical method to improve the efficiency and accuracy of unbound-state calculations in QMC. As an initial application, we compute scattering observables for the smallest system available to probe three-body forces, the neutron-triton system, using variational Monte Carlo (VMC) wave functions. The method involves inferring long-range amplitudes in the wave function from integrals over the short-range region where all the particles interact. This approach using integral relations is well established in the literature; here, we develop it for the QMC framework. We validate our approach with a consistency check between short-range spectroscopic overlap functions computed from direct evaluation and from the integral relations; scattering amplitudes are long-range asymptotics of those overlaps. Comparison against published benchmark calculations using the same potential demonstrates that when applied to the current VMC wave functions, the integral method produces more accurate scattering observables than direct evaluation from the same variational wave function. However, it still differs noticeably from the exact results. Using additional interactions, we then present phase shifts and mixing parameters for the n + 3 H system. In particular, we present one of the first applications of the Norfolk family of local coordinate-space chiral potentials in unbound systems of A > 2. The Norfolk results accurately describe s-wave scattering but predict p-wave cross sections too large. Compared with previous QMC scattering calculations, the integral method avoids difficulties associated with the precise computation of energy differences and with convergence outside the interaction region, which is particularly severe in the variational calculation. Application of the integral method here paves the way for its use in Green's function Monte Carlo (GFMC) calculations. In GFMC, the wave functions are more accurate, but the high-precision convergence of their tails is slow, and there are additional difficulties in reading out amplitudes. Here, the integral methods will address both of those remaining problems.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Comparative analysis of plasmon modes in layered Lindhard metals and strange metals

The enigmatic strange metal remains one of the central unsolved problems of 21st century science. Understanding this phase of matter requires knowledge of the momentum- and energy-resolved dynamic charge susceptibility 𝜒⁡(𝑞,𝜔), especially at finite momentum. Inelastic electron scattering (EELS), performed in either transmission or reflection geometry, is a powerful probe of 𝜒⁡(𝑞,𝜔). For the prototypical strange metal Bi 2 ⁢Sr 2 ⁢CaCu 2 ⁢O 8+𝑥 , transmission- and reflection EELS, and infrared (IR) spectroscopy agree at 𝑞∼0, all revealing a highly damped plasmon near 1 eV. At larger 𝑞, however, EELS results show unresolved discrepancies. Since IR data are highly reproducible, it is advantageous to use IR data to calculate what the expected EELS response should be at modest 𝑞. Building on prior momentum-resolved reflection geometry M-EELS work [Chen et al., Phys. Rev. B 109, 045108 (2024)], we extend this approach to transmission EELS for finite stacks of metallic layers, comparing a “textbook” Lindhard metal to a strange metal. In the Lindhard case, the low-𝑞 response is dominated by long-lived, standing wave plasmon modes arising from interlayer Coulomb coupling, with in-plane dispersions that resemble the well-known Fetter modes of layered metals. This behavior depends only on the geometry and the long-range nature of the Coulomb interaction and is largely insensitive to layer details. At larger 𝑞, the response reflects the microscopic properties of individual layers. For the strange metal, calculations based on IR data predict a highly damped plasmon with weak dispersion and no distinct surface mode. While our results match IR and M-EELS at low 𝑞, they do not reproduce any published EELS spectra at large 𝑞, highlighting unresolved discrepancies that demand further experimental investigation.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Four-dimensional dynamics of multirotational transition stimulated rotational Raman scattering in air

Stimulated rotational Raman scattering in air is a powerful parasitic process that degrades high intensity laser beams and pulses propagated over significant distances. Conversely, it is used beneficially in the context of Raman lasers. Through this inelastic scattering process, laser photons are converted to higher (anti-Stokes) or lower (Stokes) energies, according to rotational mode transitions in nitrogen and oxygen diatomic molecules. The full wave-mixing problem involves numerous frequencies, and it is consistently assumed that only one rotational mode contributes to the conversion process. We instead present a dynamic 4D multirotational model that is implemented in a parallelized manner within the Virtual Beamline++ optical modeling package allowing high-resolution 4D studies. We highlight the effect that spontaneous emission plays in large and small beam-width setups, even in the highly saturating regime. The weaker transition modes play a large role in the persistent dynamics and can lead to complex spatiotemporal coupling through nonlinear competition of the modes. We highlight how and why these weaker modes persist, how the size and shape of speckle patterns depends highly on the initial beam profile, and how weaker modes can transiently become stronger as a result of such competition.

47 OTHER INSTRUMENTATION↗

The graviton luminosity of the sun and other stars

Graviton production in electron-electron (e-e) and electron-ion (e-z) scattering is evaluated in the Born approximation. The calculation is compared with that for photon production, that is, Coulomb quadrupole bremsstrahlung, and a number of results are taken over from that problem. Application is made to the sun, and it is found that for the solar plasma the main contribution to the graviton luminosity comes from the central core at r/R approximately 0.1. The total luminosity (Lg) in gravitons is about 7.9 x 10 to the 14th ergs/s, close to an earlier estimate by Weinberg (1965, 1972); about 33 percent of the total results from e-e collisions with the rest from e-z collisions (mainly e-p and e-alpha). Approximate corrections to Born formulas are evaluated, and this Lg includes the associated (approximately + or - 10 percent, respectively) modification. The quantum-mechanical aspects of the solar Lg problem are discussed, and it is shown why a previous classical calculation overestimated Lg by about an order of magnitude. Production of gravitons in binary collisions in other types of stars is discussed briefly. It is found that Lg varies very little along the main sequence. White dwarfs have a typical graviton luminosity LWD approximately 10 to the 19th ergs/s, while neutron stars have LNS approximately 10 to the 25th ergs/s; these estimates are very rough.

Gould, R. J.↗

Pinpoint landing concepts for the Mars Rover Sample Return mission

From knowledge of hazards gained following Viking, several approaches are being pursued for making the Mars Rover Sample Return (MRSR) landing safer. With the pinpoint landing capability approach, a single landing site would be certified in advance of initiating the descent orbit, using pictures transmitted to earth from the orbiter. Onboard instruments would guide the lander to follow mapped terrain to the selected site. If navigation proves insufficiently accurate, a small number of scattered sites would be certified, and the lander would select the most accessible one in real time. Some early-site certification and navigation concepts are discussed. Some of the key problems to overcome include how to recognize hazards too small to be transmitted to earth, how to represent terrain features in the flight computer, how to overcome errors in inertial measurements during landing of over 12-hour duration, how to find the selected site in real time, and how to navigate to the selected site once it is found.

Klumpp, Allan R.↗

Photometric functions for photoclinometry and other applications

The simpler Minnaert and lunar-Lambert functions, which are needed to reduce the number of unknown parameters in photoclinometry, are presently given least-squares fits to the brightness profiles across a disk, or 'limb darkening', described by Hapke's photometric function. The variation of limb darkening with single-scattering albedo and the particle-phase function's asymmetry factor are reduced of eliminated when the Hapke parameters are in the range representative of most planetary surfaces, thereby simplifying the problem of photoclinometry across terrains with variable surface materials.

Mcewen, Alfred S.↗

Osmium Solubility in Silicate Melts: New Efforts and New Results

In a recent paper, Borisov and Palme reported the first experimental results on the partitioning of Os between metal (Ni-rich OsNi alloys) and silicate melt of anorthite-diopside eutectic composition at 1400 C and 1 atm total pressure and and at function of O2 from 10(exp -8) to 10(exp -12) atm. Experiments were done by equilibrating OsNi metal loops with silicate melt. Metal and glass were analyzed separately by INAA. D(sup 0s) ranged from 10(exp 6) to 10(exp 7), which is inconsistent with core/ mantle equilibrium for HSEs and favors the late veneer hypothesis. Unfortunately, there was practically no function of O2 dependence of Os partitioning, and the scatter of experimental results was quite serious, so the formation of Os nuggets was suspected. This new set of experiments was specifically designed to avoid of at least minimize the nugget problem

Borisov, A.↗

Obtaining the Grobner Initialization for the Ground Flash Fraction Retrieval Algorithm

At optical wavelengths and from the vantage point of space, the multiple scattering cloud medium obscures one's view and prevents one from easily determining what flashes strike the ground. However, recent investigations have made some progress examining the (easier, but still difficult) problem of estimating the ground flash fraction in a set of N flashes observed from space In the study by Koshak, a Bayesian inversion method was introduced for retrieving the fraction of ground flashes in a set of flashes observed from a (low earth orbiting or geostationary) satellite lightning imager. The method employed a constrained mixed exponential distribution model to describe the lightning optical measurements. To obtain the optimum model parameters, a scalar function of three variables (one of which is the ground flash fraction) was minimized by a numerical method. This method has formed the basis of a Ground Flash Fraction Retrieval Algorithm (GoFFRA) that is being tested as part of GOES-R GLM risk reduction.

Solakiewicz, R.↗

Multiparametric optical label-free imaging to analyze plant cell wall assembly and metabolism. (Final Report)

Plant tissues are often considered not ideal for fluorescence imaging because of the pervasive intrinsic fluorescence of many plant metabolites and the intricate interactions with light of the many semi-crystalline polymers at the cell wall. Our project aims to take advantage of this observed shortcoming by developing a label-free, optical microscopy platform for characterizing multiple fingerprints of important cell wall components and stress-related, at subcellular scale resolution. The new imaging system can collect fingerprints from both emitted and scattered light that can inform on the chemical nature, subcellular distribution, anisotropy, and molecular environment of multiple cell wall components in intact plant tissues. We are combining these imaging capabilities with computational tools that enable correlated registration, integration, and analysis. This fully integrated, multiparametric optical system will be used to address biological problems connected to cell wall assembly in grasses. This includes a focus on developmental and environmental variation of cell wall impregnation with silica, lignin, suberin, and cutin in different tissues and cell types. Our research plan comprises three main goals: (1) To develop an accessible imaging platform and associated open-source software able to extract and integrate fingerprints from fluorescence-associated (multispectral emission, lifetime, and polarization), wide-field polarimetry, second harmonic generation (SHG), and stimulated Raman scattering signals (SRS); (2) To determine unique combination of fingerprints for various cell wall components and selected metabolites; (3) To analyze the process of cell wall silicification in grasses and determine how silicification affects cell wall properties and lignin, cutin, and suberin deposition in other cell types under differ stress conditions.

59 BASIC BIOLOGICAL SCIENCES↗

Assessment of the Lagrange Discrete Ordinates Equations for Three-Dimensional Neutron Transport

The Lagrange Discrete Ordinates (LDO) equations, developed by Ahrens as an alternative to the traditional discrete ordinates formulation, have been implemented in Denovo, a threedimensional radiation transport code developed by Oak Ridge National Laboratory. The LDO equations retain the formal structure of the classical discrete ordinates equations but treat particle scattering in a different way. Solutions of the LDO equations have an interpolatory structure such that the angular flux can be naturally evaluated at directions other than the discrete ordinates used in arriving at the solutions, and the ordinates themselves may be chosen in a strategic way for the problem under consideration. Of particular interest is that the LDO equations have been shown to mitigate ray effects at increased angular resolutions. In this paper we present scalar flux solutions of the LDO equations for a small number of test cases of interest and compare the results against flux solutions generated using standard quadrature types. The LDO equations’ flux solutions were found to be comparable to those resultant from the standard quadrature types in value; results from the LDO equations were also found to be commensurate with those of standard quadrature types when comparing the flux solutions in the context of the experimental benchmark test case examined.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Multi-Parameter Aerosol Scattering Sensor

This work relates to the development of sensors that measure specific aerosol properties. These properties are in the form of integrated moment distributions, i.e., total surface area, total mass, etc., or mathematical combinations of these moment distributions. Specifically, the innovation involves two fundamental features: a computational tool to design and optimize such sensors and the embodiment of these sensors in actual practice. The measurement of aerosol properties is a problem of general interest. Applications include, but are not limited to, environmental monitoring, assessment of human respiratory health, fire detection, emission characterization and control, and pollutant monitoring. The objectives for sensor development include increased accuracy and/or dynamic range, the inclusion in a single sensor of the ability to measure multiple aerosol properties, and developing an overall physical package that is rugged, compact, and low in power consumption, so as to enable deployment in harsh or confined field applications, and as distributed sensor networks. Existing instruments for this purpose include scattering photometers, direct-reading mass instruments, Beta absorption devices, differential mobility analyzers, and gravitational samplers. The family of sensors reported here is predicated on the interaction of light and matter; specifically, the scattering of light from distributions of aerosol particles. The particular arrangement of the sensor, e.g. the wavelength(s) of incident radiation, the number and location of optical detectors, etc., can be derived so as to optimize the sensor response to aerosol properties of practical interest. A key feature of the design is the potential embodiment as an extremely compact, integrated microsensor package. This is of fundamental importance, as it enables numerous previously inaccessible applications. The embodiment of these sensors is inherently low maintenance and high reliability by design. The novel and unique features include the underlying computational underpinning that allows the optimization for specific applications, and the physical embodiment that affords the construction of a compact, durable, and reliable integrated package. The advantage appears in the form of increased accuracy relative to existing instruments, and the applications enabled by the physical attributes of the resulting configuration

Greenberg, Paul S.↗

A magnon band analysis of GdRu 2 Si 2 in the field-polarized state

Understanding the formation of skyrmions in centrosymmetric materials is a problem of fundamental and technological interest. GdRu 2 Si 2 is a candidate material that hosts a variety of multi-Q magnetic phases, including in zero-field. Here, inelastic neutron scattering is used to measure the spin excitations in the field-polarized phase of GdRu 2 Si 2 . Linear spin wave theory and a method of interaction invariant path analysis are used to derive a Hamiltonian accounting for the spectra. The Hamiltonian, dominated by bilinear (Ruderman-Kittel-Kasuya-Yosida) Heisenberg exchange, compares favorably to ab initio calculations. Dipolar interactions are a secondary energy scale to consider, with J D.D ~ 0.05 J RKKY . However, it is shown that in the field-polarized phase the dipolar interactions ‘self screen’ so that their effect is largely suppressed. No specific evidence for higher-order exchange is found. These aspects are discussed in the context of the lower field multi-Q states and the anisotropy of the system.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗