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At least 91 records · Page 5

Electron–phonon interaction in Kondo lattice systems

Highlights: • Rigorous study of ground state properties of the Kondo lattice model with an electron–phonon. • The ground state is proved to be unique. • The total spin of the ground state is determined according to the lattice structure. • Novel applications of order preserving operator inequalities. We study ground state properties of the Kondo lattice model with an electron–phonon interaction. The ground state is proved to be unique; in addition, the total spin of the ground state is determined according to the lattice structure. To prove the assertions, an extension of the method of spin reflection positivity is given in terms of order preserving operator inequalities.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Duality and supersymmetry constraints on the weak gravity conjecture

Positivity bounds coming from consistency of UV scattering amplitudes are not always sufficient to prove the weak gravity conjecture for theories beyond Einstein-Maxwell. Additional ingredients about the UV may be necessary to exclude those regions of parameter space which are naïvely in conflict with the predictions of the weak gravity conjecture. In this paper we explore the consequences of imposing additional symmetries inherited from the UV theory on higher-derivative operators for Einstein-Maxwell-dilaton-axion theory. Using black hole thermodynamics, for a preserved SL(2, $\mathbb{R}$) symmetry we find that the weak gravity conjecture then does follow from positivity bounds. For a preserved O(d, d; $\mathbb{R}$) symmetry we find a simple condition on the two Wilson coefficients which ensures the positivity of corrections to the charge-to-mass ratio and that follows from the null energy condition alone. We find that imposing supersymmetry on top of either of these symmetries gives corrections which vanish identically, as expected for BPS states.

79 ASTRONOMY AND ASTROPHYSICS↗

Sample 67215: An Anomalous Ferroan Anorthosite

Sample 67215c is a ferroan anorthosite clast with an age of 4.4 Ga and a positive Nd. The sample has a well preserved microcumulate texture. Relatively rapid cooling rates coupled with preserved pigeonite are consistent with a shallow (<1 km) origin. Additional information is contained in the original extended abstract.

McCallum, I. S.↗

Comparison of the Mineralogy of Comet Wild 2 Coma Grains to Other Astromaterials

We propose that Kuiper Belt samples (in this case comet coma grains from the Jupiter family comet Wild 2) are recognizably different from the bulk of materials in outer belt asteroids, because of their different formation positions and times in the early solar system. We believe this despite similarities found between some Wild 2 grains and components of carbonaceous chondrites (i.e. some CAI and chondrules). Kuiper Belt samples must preserve measurable mineralogical and compositional evidence of formation at unique positions and times in the early solar nebula, and these formational differences must have imparted recognizable special characteristics. We hypothesize that these characteristics include: (1) Unique major element compositional ranges of common astromaterial minerals, especially olivine and pyroxene; (2) Unique minor element compositions of major silicate phases, especially olivine and low-Ca pyroxene; (3) Degree and effects of radiation processing -- including amorphous rims, metal coatings, and Glass with Embedded Metal and Sulfides (GEMS); (4) Presence of abundant presolar silicate grains as recognized by anomalous oxygen in silicates; (5) Oxidation state of the mineral assemblage. We are working our way through all available Wild 2 samples, selecting 1-2 non-consecutive viable TEM grids from each possible extracted Wild 2 grain. We especially prefer TEM grids from grains for which complete mineralogical details have not been published (which is to say the majority of the extracted grains). We are performing a basic mineralogic survey by E-beam techniques, to establish the essential features of the extracted Wild 2 grains. We are making a particular effort to carefully and accurately measure minor elements of olivine and pyroxene, as these minerals are widespread in astromaterials, and comparisons of their compositions will serve to place the Wild 2 silicates in contact with asteroids, meteorites and chondritic interplanetary dust particles processing. We are also making a special effort to search for mineralogical products of aqueous alteration, since their presence would reveal that Wild 2 was once internally heated, a result with dramatic implications for models of early solar system primitive bodies. Thus far carbonates are the only potential evidence for aqueous alteration for Wild 2.

Frank, David↗

Framework for simulating gauge theories with dipolar spin systems

Gauge theories appear broadly in physics, ranging from the standard model of particle physics to long-wavelength descriptions of topological systems in condensed matter. However, systems with sign problems are largely inaccessible to classical computations and also beyond the current limitations of digital quantum hardware. In this work, we develop an analog approach to simulating gauge theories with an experimental setup that employs dipolar spins (molecules or Rydberg atoms). We consider molecules fixed in space and interacting through dipole-dipole interactions, avoiding the need for itinerant degrees of freedom. Each molecule represents either a site or gauge degree of freedom, and Gauss's law is preserved by a direct and programmatic tuning of positions and internal state energies. This approach can be regarded as a form of analog systems programming and charts a path forward for near-term quantum simulation. As a first step, we numerically validate this scheme in a small-system study of U(1) quantum link models in (1+1) dimensions with link spin S = 1/2 and S =1 and illustrate how dynamical phenomena such as string inversion and string breaking could be observed in near-term experiments. Our work brings together methods from atomic and molecular physics, condensed matter physics, high-energy physics, and quantum information science for the study of nonperturbative processes in gauge theories.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Solar-Tracker Diffuse-Response Algorithm for Balancing Energy Gain and Mechanical Wear in Photovoltaic Systems

Single-axis solar tracking maximizes photovoltaic energy production under clear-sky conditions; however, its effectiveness decreases under cloudy and overcast skies, where diffuse irradiance dominates and the optimal module orientation changes. Conventional tracking algorithms either neglect sky conditions or rely on simplified diffuse-response strategies that may trigger frequent tracker repositioning under variable cloud cover, leading to increased mechanical wear with marginal energy gains. This work proposes an enhanced diffuse-response tracking algorithm that explicitly accounts for both the intensity and temporal persistence of cloudiness. By requiring overcast conditions to persist for a minimum duration before reorienting the tracker to a diffuse-stow position, the proposed approach reduces unnecessary movements while preserving the benefits of diffuse-response operation. The algorithm is evaluated through numerical simulations based on historical meteorological data and validated using field measurements on monofacial and bifacial photovoltaic strings. The results show that the proposed strategy reduces excess tracker movement from 114% to 0.16% while maintaining nearly the same energy yield. Compared to a conventional diffuse-response algorithm, the associated energy reduction is minimal (≈0.17%) relative to the ≈0.37% yield gain observed at the studied location. These findings demonstrate that incorporating cloudiness duration enables a practical compromise between energy performance and tracker durability, particularly for monofacial photovoltaic systems.

14 SOLAR ENERGY↗

Positioning bars for large wire harnesses

By tying positioning bars to harness, its configuration can be preserved during transport, thus facilitating installation. Harness can also be showed temporarily by placing hanging hooks on end of bar.

Glessner, J. R.↗

Early Holocene cold snaps and their expression in the moraine record of the eastern European Alps

Glaciers preserve climate variations in their geological and geomorphological records, which makes them prime candidates for climate reconstructions. Investigating the glacier–climate system over the past millennia is particularly relevant first because the amplitude and frequency of natural climate variability during the Holocene provides the climatic context against which modern, human-induced climate change must be assessed. Second, the transition from the last glacial to the current interglacial promises important insights into the climate system during warming, which is of particular interest with respect to ongoing climate change. Evidence of stable ice margin positions that record cooling during the past 12 kyr are preserved in two glaciated valleys of the Silvretta Massif in the eastern European Alps, the Jamtal (JAM) and the Laraintal (LAR). We mapped and dated moraines in these catchments including historical ridges using beryllium-10 surface exposure dating (10Be SED) techniques and correlate resulting moraine formation intervals with climate proxy records to evaluate the spatial and temporal scale of these cold phases. The new geochronologies indicate the formation of moraines during the early Holocene (EH), ca. 11.0 ± 0.7 ka (n = 19). Boulder ages along historical moraines (n = 6) suggest at least two glacier advances during the Little Ice Age (LIA; ca. 1250–1850 CE) around 1300 CE and in the second half of the 18th century. An earlier advance to the same position may have occurred around 500 CE. The Jamtal and Laraintal moraine chronologies provide evidence that millennial-scale EH warming was superimposed by centennial-scale cooling. The timing of EH moraine formation coincides with brief temperature drops identified in local and regional paleoproxy records, most prominently with the Preboreal Oscillation (PBO) and is consistent with moraine deposition in other catchments in the European Alps and in the Arctic region. This consistency points to cooling beyond the local scale and therefore a regional or even hemispheric climate driver. Freshwater input sourced from the Laurentide Ice Sheet (LIS), which changed circulation patterns in the North Atlantic, is a plausible explanation for EH cooling and moraine formation in the Nordic region and in Europe.

54 ENVIRONMENTAL SCIENCES↗

Transient Stability Study of IEEE 2800-2022 Standard Negative-Sequence-Current Compliant GFM IBRs

The primary function of grid-forming (GFM) inverter-based resources (IBRs) is to maintain voltage and fre- quency/phase angle stability; however, during unbalanced grid faults, IEEE Std. 2800-2022 requires IBRs to inject both positive- and negative-sequence reactive current. Enforcing compliance with this standard could compromise the stability of GFM IBRs under such fault conditions. This paper presents a preliminary transient stability study focused on the power angle stability of GFM IBRs operating in compliance with IEEE Std. 2800 during unbalanced faults. The goal is to assess potential stability issues associated with the standard's current injection requirements under fault ride-through conditions. The results show that injecting positive-sequence current with d-axis priority during unbalanced faults better preserves the power angle stability than the q-axis priority while still enabling negative-sequence current injection. These findings suggest that, to ensure stability, GFM IBRs might need to partially comply with IEEE Std. 2800 by prioritizing positive-sequence current injection along the d-axis.

14 SOLAR ENERGY↗

Position Papers for the ASCR Workshop on Cybersecurity and Privacy for Scientific Computing Ecosystems

At the request of the Department of Energy's (DOE) Office of Advanced Scientific Computing Research (ASCR), this program committee has been tasked with organizing a workshop to identify basic research needs in cybersecurity and privacy to better support DOE's science and energy mission. As part of the process, the program committee is soliciting community input in the form of position papers to help identify significant use cases, facility issues, and other barriers to enabling verifiably trustworthy computational science while preserving data confidentiality as appropriate for scientific workflows of interest to DOE. The program committee will review these position papers and based on the fit of their area of expertise and interest, selected contributors will have the opportunity to participate in the workshop currently planned as a virtual event November 3-5th, 2021. The thrust areas that will be explored by this workshop are the following: (1) Algorithms for secure, scalable, privacy-enhancing technologies and frameworks, including: Federated AI/ML, Differential privacy, Randomized algorithms, Adversarial modeling & simulation, Graph algorithms, and Formal methods; (2) Platforms to support the entire scientific-computing ecosystem, including edge computing for large-scale experiments, focusing on heterogeneous systems and distributed systems, including: Heterogeneous computing systems, Distributed computing systems, and Secure data architectures; and (3) Data workflows to allow agile use of data while preserving integrity and privacy, making the important properties verifiable either at runtime or post-computation, including: Integrity and provenance and Data management infrastructure. Topics that are out-of-scope for the workshop include discussing specific proposed solutions or areas that are clearly out of DOE's fundamental and applied-sciences mission scope, e.g., cryptography, enterprise security, and general-operations technology.

97 MATHEMATICS AND COMPUTING↗

Structural, Electronic, and Electrostatic Determinants for Inhibitor Binding to Subsites S1 and S2 in SARS-CoV-2 Main Protease

Creating small-molecule antivirals specific for severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) proteins is crucial to battle coronavirus disease 2019 (COVID-19). SARS-CoV-2 main protease (Mpro) is an established drug target for the design of protease inhibitors. We performed a structure–activity relationship (SAR) study of noncovalent compounds that bind in the enzyme’s substrate-binding subsites S1 and S2, revealing structural, electronic, and electrostatic determinants of these sites. The study was guided by the X-ray/neutron structure of Mpro complexed with Mcule-5948770040 (compound 1), in which protonation states were directly visualized. Virtual reality-assisted structure analysis and small-molecule building were employed to generate analogues of 1. In vitro enzyme inhibition assays and room-temperature X-ray structures demonstrated the effect of chemical modifications on Mpro inhibition, showing that (1) maintaining correct geometry of an inhibitor’s P1 group is essential to preserve the hydrogen bond with the protonated His163; (2) a positively charged linker is preferred; and (3) subsite S2 prefers nonbulky modestly electronegative groups.

60 APPLIED LIFE SCIENCES↗

Unification of some advection schemes in two dimensions

The relationship between two approaches towards construction of genuinely two-dimensional upwind advection schemes is established. One of these approaches is of the control volume type applicable on structured cartesian meshes. It resulted in the compact high resolution schemes capable of maintaining second order accuracy in both homogeneous and inhomogeneous cases. Another one is the fluctuation splitting approach, which is well suited for triangular (and possibly) unstructured meshes. Understanding the relationship between these two approaches allows us to formulate here a new fluctuation splitting high resolution (i.e. possible use of artificial compression, while maintaining positivity property) scheme. This scheme is shown to be linearity preserving in inhomogeneous as well as homogeneous cases.

Sidilkover, D.↗

Fluorescent, phosphorescent, magnetic resonance contrast and radioactive tracer labelling of extracellular vesicles

This review focusses on the significance of fluorescent, phosphorescent labelling and tracking of extracellular vesicles (EVs) for unravelling their biology, pathophysiology, and potential diagnostic and therapeutic uses. Various labeling strategies, such as lipid membrane, surface protein, luminal, nucleic acid, radionuclide, quantum dot labels, and metal complex-based stains, are evaluated for visualizing and characterizing EVs. Direct labelling with fluorescent lipophilic dyes is simple but generally lacks specificity, while surface protein labelling offers selectivity but may affect EV-cell interactions. Luminal and nucleic acid labelling strategies have their own advantages and challenges. Here, each labelling approach has strengths and weaknesses, which require a suitable probe and technique based on research goals, but new tetranuclear polypyridylruthenium(II) complexes as phosphorescent probes have strong phosphorescence, selective staining, and stability. Future research should prioritize the design of novel fluorescent probes and labelling platforms that can significantly enhance the efficiency, accuracy, and specificity of EV labeling, while preserving their composition and functionality. It is crucial to reduce false positive signals and explore the potential of multimodal imaging techniques to gain comprehensive insights into EVs.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Deployment of Community Scale Solar Photovoltaic Energy Systems in Forest County Potawatomi Community

FCPC is a federally recognized tribe with a membership of more than 1400. The Tribe has a reservation in Forest County, Wisconsin, and tribal trust lands in Milwaukee County, Wisconsin, with significant governmental and business operations in both areas. Until relatively recently, FCPC was one of the poorest tribes in the Midwest. Due to its successful gaming operations, it now has improved its financial situation and is using its resources to benefit both its members and the general public through environmental and other community efforts, many of which are long-delayed because of the extended period of abject poverty. The Tribe has developed the long-term goal of becoming energy independent using renewable resources. In order to meet this goal, the Tribe has taken several important steps. As an interim step, FCPC is purchasing nearly 55 million kilowatt hours of renewable energy certificates (“RECs”) annually from certified renewable energy facilities in the United States. These RECs offset more than 100% of the present electricity use at all of the Tribe’s facilities. The Tribe is currently ranked number 11 on the Environmental Protection Agency’s (EPA) Top 20 Local Government list of green power purchasers and is a member of the EPA’s Green Power Partnership. The original project suggested small scale installations on tribal homes and certain government buildings. The Tribe suggested that the project would result in 730 kw installed. By revising the project, the Tribe was able to install 938 kw and owns the largest installation in Northern Wisconsin with the 800 kW installation at the Potawatomi Carter Casino Hotel (“PCCH”). The PCCH installation, in summer months, can provide near 90% of the use during daylight hours. Although tracking was not immediately available FCPC has since confirmed significant production with certain quarterly savings nearing $210,000. These installations provide a reduction in facility costs providing more revenue for Tribal services including cultural, health, sustainable food sources, environmental preservation and other Tribal initiatives. Further, the installations have resulted in positive steps towards the Tribe’s goals of energy sovereignty and the use of 100% renewable clean energy. Finally, the PCCH project, specifically, has had the additional benefit of providing a likely area for a microgrid. The size of the installation and offset achieved have pushed the Tribe toward planning for storage and a microgrid system that would both further the Tribe’s energy goals and provide a safe haven for the Community during times of need.

14 SOLAR ENERGY↗

Indications of fluid immiscibility in glass from West Clearwater Lake impact crater, Quebec, Canada

Glass from the West Clearwater Lake hypervelocity impact crater contains numerous spheroids, 10 to 500 microns across, which appear to have formed at high temperatures as fluids immiscible in the enclosing melt. The spheroids are distinguished from small, normal, largely void gas vesicles, which are also present, by being completely filled in all cases; by having fillings which vary in composition from spheroid to spheroid, even between spheroids in close association; and by indications that the present fillings are representative of the contents present before the matrix melt chilled. Most of the spheroids are classified petrographically into three types. The preservation of spheroids in the West Clearwater Lake glass is attributed mainly to the position of the glass masses within the breccias lining the crater floor. It is considered that the glass in this location did not achieve free flight but, as part of a large mass, cooled relatively slowly through the high temperature regime in which the spheroids were generated, and then, when detached, chilled rapidly to preserve a record of this transient stage in their history.

Dence, M. R.↗

Toggling Stereochemical Activity through Interstitial Positioning of Cations between 2D V 2 O 5 Double Layers

The 5/6s 2 lone-pair electrons of p-block cations in their lower oxidation states are a versatile electronic and geometric structure motif that can underpin lattice anharmonicity and often engender electronic and structural instabilities that underpin the function of active elements in nonlinear optics, thermochromics, thermoelectrics, neuromorphic computing, and photocatalysis. In contrast to periodic solids where lone-pair-bearing cations are part of the structural framework, installing lone-pair-bearing cations in the interstitial sites of intercalation hosts provides a means of a systematically modulating electronic structure through the choice of the group and the period of the inserted cation while preserving the overall framework connectivity. The extent of stereochemical activity and the energy positioning of lone-pair-derived mid-gap states depend on the cation identity, stoichiometry, and strength of anion hybridization. V 2 O 5 polymorphs are versatile insertion hosts that can accommodate a broad range of s-, p-, and d-block cations. However, the insertion of lone-pair-bearing cations remains largely underexplored. In this article, we examine the implications of varying the 6s 2 cations situated in interlayer sites between condensed [V 4 O 10 ] n double layers. Systematic modulations of lattice distortions, electronic structure, and magnetic ordering are observed with increasing strength of stereochemical activity from group 12 to group 14 cations. We compare and contrast p-block-layered M x V 2 O 5 (M = Hg, Tl, and Pb) compounds and map the significance of local off-centering arising from the stereochemical activity of lone-pair cations to the emergence of filled antibonding lone-pair 6s 2 –O 2p-hybridized mid-gap states mediated by second-order Jahn–Teller distortions. Crystallographic studies of cation coordination environments and the resulting modulation of V–V interactions have been used in conjunction with variable-energy hard X-ray photoelectron spectroscopy measurements, first-principles electronic structure calculations, and crystal orbital Hamilton population analyses to decipher the origins of stereochemical activity. Magnetic susceptibility measurements reveal antiferromagnetic signatures for all the three compounds. However, the differences in V–V interactions significantly affect the energy balance of the superexchange interactions, resulting in an ordering temperature of 160 and 260 K for Hg 0.5 V 2 O 5 and δ-Tl 0.5 V 2 O 5 , respectively, as compared to 7 K for δ-Pb 0.5 V 2 O 5 . In δ-Pb 0.5 V 2 O 5 , the strong stereochemical activity of electron lone pairs and the resulting electrostatic repulsions enforce superlattice ordering, which strongly modifies the electronic localization patterns along the [V 4 O 10 ] slabs, resulting in disrupted magnetic ordering and an anomalously low ordering temperature. The results demonstrate a versatile strategy for toggling the stereochemical activity of electron lone pairs to modify the electronic structure near the Fermi level and to mediate superexchange interactions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The sequence of prime gaps is graphic

Let us call a simple graph on $n$ ≥ 2 vertices a prime gap graph if its vertex degrees are 1 and the first $n$ - 1 prime gaps. We show that such a graph exists for every large n, and in fact for every $n$ ≥ 2 if we assume the Riemann hypothesis. Moreover, an infinite sequence of prime gap graphs can be generated by the so-called degree preserving growth process. This is the first time a naturally occurring infinite sequence of positive integers is identified as graphic. That is, we show the existence of an interesting, and so far unique, infinite combinatorial object.

97 MATHEMATICS AND COMPUTING↗

Endothelium Preserving Microwave Treatment for Atherosclerosis

Method and apparatus are provided to treat atherosclerosis wherein the artery is partially closed by dilating the artery while preserving the vital and sensitive endothelial layer thereof Microwave energy having a frequency from 3 GHz to 300 GHz is propagated into the arterial wall to produce a desired temperature profile therein at tissue depths sufficient for thermally necrosing connective tissue and softening fatty and waxy plaque while limiting heating of surrounding tissues including the endothelial laser and/or other healthy tissue, organs, and blood. The heating period for raising the temperature a potentially desired amount, about 20 C., within the atherosclerotic lesion may be less than about one second. In one embodiment of the invention, a radically beveled waveguide antenna is used to deliver microwave energy at frequencies from 25 GHz or 30 GHz to about 300 GHz and is focused towards a particular radial sector of the artery. Because the atherosclerotic lesions are often asymmetrically disposed, directable of focussed heating preserves healthy sectors of the artery and applies energy to the asymmetrically positioned lesion faster than a non-directed beam. A computer simulation predicts isothermic temperature profiles for the given conditions and man be used in selecting power, pulse duration, beam width, and frequency of operation to maximize energy deposition and control heat rise within the atherosclerotic lesion without harming healthy tissues or the sensitive endothelium cells.

Carl, James R.↗