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At least 199 records · Page 11
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

A realistic theory of E6 unification through novel intermediate symmetries

Abstract We propose a non-supersymmetric E 6 GUT with the scalar sector consisting of650⨁351′ ⨁27. Making use of the first representation for the initial symmetry breaking to an intermediate stage, and the latter two representations for second-stage breaking to the Standard Model and a realistic Yukawa sector, this theory represents the minimal E 6 GUT that proceeds through one of the intermediate stages that are novel compared to SU(5) or SO(10) GUT: trinification SU(3) C × SU(3) L × SU(3) R , SU(6) × SU(2) and flipped SO(10) × U(1). We analyze these possibilities under the choice of vacuum that preserves a ℤ 2 “spinorial parity”, which disentangles the chiral and vector-like fermions of E 6 and provides a dark matter candidate in the form of a (scalar) inert doublet. Three cases are shown to consistently unify under the extended survival hypothesis (with minimal fine-tuning): trinification symmetry SU(3) C × SU(3) L × SU(3) R with eitherLRorCRparity, and SU(6) CR × SU(2) L . Although the successful cases give a large range for proton lifetime estimates, all of them include regions consistent with current experimental bounds and within reach of forthcoming experiments. The scenario investigated in this paper essentially represents the unique (potentially) viable choice in the class of E 6 GUTs proceeding through a novel-symmetry intermediate stage, since non-minimal alternatives seem to be intrinsically non-perturbative.

Physics↗
DOE OSTI2024

Origin of anomalous magnetotransport in kagome superconductors 𝐴⁢V 3 ⁢Sb 5 (𝐴 = K,Rb,Cs)

Multiple anomalous features in electronic spectra of metals with a kagome lattice structure—van Hove singularities, Dirac points, and flat bands—imply that materials containing this structural motif may lie at a nexus of topological and correlated electron physics. Due to the prospects of such exceptional electronic behavior, the recent discovery of superconductivity coexisting with charge-density wave (CDW) order in the layered kagome metals 𝐴⁢V 3 ⁢Sb 5 (𝐴 = K,Rb,Cs) has attracted considerable attention. Notably, these archetypal kagome metals express unconventional magnetotransport behavior, including an unexpected linear-in-𝐻 diagonal resistivity at low fields, and an even more peculiar, nonmonotonic sign-changing behavior of the Hall resistivity, which has been speculated to arise from a chiral CDW. We argue here that this unusual magnetotransport derives not from such unconventional phenomena, but rather from the unique fermiology of the 𝐴⁢V 3 ⁢Sb 5 materials. Specifically, it is caused by a large, concave hexagonal Fermi surface sheet formed in the close proximity to the van Hove singularities, which is backfolded into a small hexagonal sheet and two large triangular sheets in the CDW state. We introduce and analyze a model of the electronic structure of these Fermi surface sheets that allows for a full analytical treatment within Boltzmann kinetic theory and that enables semi-quantitative fits of our transport data. Specifically, we find that the anomalous magnetotransport behavior is caused by the confluence of strong reduction of the Fermi velocity near the van Hove singularities located near the vertices of the hexagonal sheet and sharp corners in Fermi surface generated by the CDW reconstruction. In conclusion, our analytical approach not only explains the anomalous magnetotransport in the kagome superconductors but also can be extended to a variety of metallic systems hosting singular features in their Fermi surfaces.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2026

Kaon leptonic and semileptonic decays with $N_f=2+1+1$ HISQ fermions

Precision tests of the Standard Model (SM) currently show a deficit in first-row Cabibbo-Kobayashi-Maskawa (CKM) unitarity. In this talk, we discuss progress towards a correlated analysis of the lattice-QCD inputs needed to test this relation with kaon data using highly improved staggered quarks (HISQ) on the MILC $N_{f}=2+1+1$ configurations. We present the status of a new analysis of light-meson decay constant data where chiral-continuum fits are guided by staggered chiral perturbation theory (SChPT). The goal of SChPT is twofold: it allows us to use data not only at physical pion mass but also at unphysical masses. Moreover, it provides values of ChPT low energy constants (LECs) as well as their correlations. We also present a reanalysis of our previous kaon semileptonic form factor calculation, aiming to estimate correlations between the form factor and light-meson decay constants. We discuss the new methodology, new data included, and present some preliminary results.

Merino, Ramón [Granada U.] (ORCID:000900039150393X↗
DOE OSTI2024

Influence of globally spin-aligned vector mesons to the measurements of the chiral magnetic effect in heavy-ion collisions

The chiral magnetic effect (CME) in high-energy heavy-ion collisions arises from the interplay between the chirality imbalance and the intense magnetic field and will cause a charge separation along the magnetic field direction. While the CME search is still ongoing in experiments, the non-CME contributions need to be excluded from the CME observables. In this work, we examine the influence of globally spin-aligned ρ mesons on the γ 112 correlator, the R Ψ 2 (ΔS) correlator, and the signed balance functions, via a toy model and a multiphase transport model (AMPT). We find that the CME observables are sensitive to the 00-component of the spin density matrix, ρ 00 : they receive positive (negative) contributions when ρ 00 is larger (smaller) than 1/3.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Search for the Chiral Magnetic Effect with charge-dependent azimuthal correlations in Xe–Xe collisions at s NN = 5.44 TeV

Charge-dependent two- and three-particle correlations measured in Xe–Xe collisions at $\sqrt{s_{NN}}$ = TeV are presented. Results are obtained for charged particles in the pseudorapidity range |η| and transverse momentum interval 02. ≤ p T < GeV/c for different collision centralities. The three-particle correlator γ αβ ≡ $\langle$cos(φ α + φ β - 2Ψ a )$\rangle$, calculated for different combinations of charge sign α and β, is expected to be sensitive to the presence of the Chiral Magnetic Effect (CME). Its magnitude is similar to the one observed in Pb–Pb collisions in contrast to a smaller CME signal in Xe–Xe collisions than in Pb–Pb collisions predicted by Monte Carlo (MC) calculations including a magnetic field induced by the spectator protons. These observations point to a large non-CME contribution to the correlator. Furthermore, the charge dependence of γ αβ can be described by a blast wave model calculation that incorporates background effects and by the Anomalous Viscous Fluid Dynamics model with values of the CME signal consistent with zero. The Xe–Xe and Pb–Pb results are combined with the expected CME signal dependence on the system size from the MC calculations including a magnetic field to obtain the fraction of CME contribution in γ αβ , $f$ CME . The CME fraction is compatible with zero for the 30% most central events in both systems and then becomes positive. This yields an upper limit of 2% (3%) and 25% (32%) at 95% (99.7%) confidence level for the CME signal contribution to γ αβ in the 0–70% Xe–Xe and Pb–Pb collisions, respectively.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS2011

Primordial Synthesis of Amines and Amino Acids in a 1958 Miller H2S-Rich Spark Discharge Experiment

Archived samples from a previously unreported 1958 Stanley Miller electric discharge experiment containing hydrogen sulfide (H2S) were recently discovered and analyzed using high-performance liquid chromatography and time-of-flight mass spectrometry. We report here the detection and quantification of primary amine-containing compounds in the original sample residues, which were produced via spark discharge using a gaseous mixture of H2S, CH4, NH3, and CO2. A total of 23 amino acids and 4 amines, including 7 organosulfur compounds, were detected in these samples. The major amino acids with chiral centers are racemic within the accuracy of the measurements, indicating that they are not contaminants introduced during sample storage. This experiment marks the first synthesis of sulfur amino acids from spark discharge experiments designed to imitate primordia! environments. The relative yield of some amino acids, in particular the isomers of aminobutyric acid, are the highest ever found in a spark discharge experiment. The simulated primordial conditions used by Miller may serve as a model for early volcanic plume chemistry and provide insight to the possible roles such plumes may have played in abiotic organic synthesis. Additionally, the overall abundances of the synthesized amino acids in the presence of H2S are very similar to the abundances found in some carbonaceous meteorites, suggesting that H2S may have played an important role in prebiotic reactions in early solar system environments.

Parker, Eric T.↗
NASA NTRS2023

The Eruption of A Magnetic Flux Rope Observed By Solar Orbiter and Parker Solar Probe

Magnetic flux ropes are a key component of coronal mass ejections, forming the core of these eruptive phenomena. However, determining whether a flux rope is present prior to eruption onset and, if so, the rope's handedness and the number of turns that any helical field lines make is difficult without magnetic field modeling or in situ detection of the flux rope. We present two distinct observations of plasma flows along a filament channel on 2022 September 4 and 5 made using the Solar Orbiter spacecraft. Each plasma flow exhibited helical motions in a right-handed sense as the plasma moved from the source active region across the solar disk to the quiet Sun, suggesting that the magnetic configuration of the filament channel contains a flux rope with positive chirality and at least one turn. The length and velocity of the plasma flow increased from the first to the second observation, suggesting evolution of the flux rope, with the flux rope subsequently erupting within ∼5 hr of the second plasma flow. The erupting flux rope then passed over the Parker Solar Probe spacecraft during its encounter (13), enabling in situ diagnostics of the structure. Although complex and consistent with the flux rope erupting from underneath the heliospheric current sheet, the in situ measurements support the inference of a right-handed flux rope from remote-sensing observations. These observations provide a unique insight into the eruption and evolution of a magnetic flux rope near the Sun.

David M. Long↗
DOE OSTI2024

Longitudinal form Factors of A ≤ 10 Nuclei in a Chiral Effective Field Theory Approach

Here, in this work, we present the elastic electron scattering longitudinal form factors of A ≤ 10 nuclei computed in a variational Monte Carlo approach. We employ the Norfolk family of local chiral interactions and a consistent electromagnetic charge operator. Our calculations are compared both to data and past theoretical evaluations. This work represents, to our knowledge, the first accurate calculation of longitudinal form factors using manybody methods based on interacting nucleon degrees of freedom in the 7 ≤ A ≤ 10 mass range. Finally, we identify 9 Be and 10 B as candidate targets for renewed experimental interest, as they exhibit the potential to provide more stringent constraints on the theoretical models.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Studying the interaction between charm and light-flavor mesons

The two-particle momentum correlation functions between charm mesons ( D * ± and D ± ) and charged light-flavor mesons ( π ± and K ± ) in all charge combinations are measured for the first time by the ALICE Collaboration in high-multiplicity proton–proton collisions at a center-of-mass energy of s = 13 TeV . For DK and D * K pairs, the experimental results are in agreement with theoretical predictions of the residual strong interaction based on quantum chromodynamics calculations on the lattice and chiral effective field theory. In the case of D π and D * π pairs, tension between the calculations including strong interactions and the measurement is observed. For all particle pairs, the data can be adequately described by Coulomb interaction only, indicating a shallow interaction between charm and light-flavor mesons. Finally, the scattering lengths governing the residual strong interaction of the D π and D * π systems are determined by fitting the experimental correlation functions with a model that employs a Gaussian potential. The extracted values are small and compatible with zero. © 2024 CERN, for the ALICE Collaboration 2024 CERN

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

3D-printed mirror-less helicity preserving metasurface “mirror” for THz applications

Stimulated by seminal works on generalized reflection and refraction laws, metasurfaces have evolved to a highly promising research direction, as they allow a multitude of different functionalities by optically thin wave-control elements/structures. Among them, structures functioning in the low THz regime are of extensive research interest, due to their high potential in communication and sensing applications. In this paper we propose a simple THz metasurface design that exhibits ideally perfect cross-polarized reflection for linear polarization and perfect helicity-preserving reflection with a geometric (Pancharatnam–Berry) phase for circular polarization, without the presence of any back-reflector. Numerical calculations demonstrating the structure response are justified by analytical models, which provide physical insights on this response. The designed metasurfaces are fabricated using the direct laser writing 3D-printing technology, metallized with electroless silver plating, and are characterized by THz time domain spectroscopy, with the experimental results validating the corresponding theoretical ones. Applications including beam steering and focusing, exploring the Pancharatnam–Berry phase, are also demonstrated numerically. Besides those applications, the helicity preserving mirror response of our metasurfaces can be valuable, among others, also in molecular chirality sensing applications, an issue that is also highlighted here.

3D-printed metasurfaces↗
NASA NTRS2011

New Insights into Prebiotic Chemistry from Old Archived Miller Extracts

Following the discovery of an archived set of samples from Stanley Miller's early experiments, analyses were undertaken to better understand the diversity of compounds produced from electric discharges acting on reducing gas mixtures. The paper chromatography methods that Miller used in the 1950s were only capable of detecting a few amino acids and were unable to provide substantial quantitative data relative to today's techniques. Current analytical techniques are much more sensitive and selective, and are capable of precisely quantifying a much larger range of amino acids and their enantiomeric abundances. In one study, preserved dried samples produced by Miller using a lesser-known volcanic apparatus which differed from Miller's classic apparatus in that it utilized an aspirator that injected steam into the electric discharge chamber, simulating a volcanic eruption. The volcanic apparatus produced a wider variety of amino acids than the classic configuration. Prebiotic compounds synthesized in these environments may have locally accumulated where they could have undergone further processing. An additional preserved set of samples from an experiment conducted in 1958 were also found in Miller's archived collection. These samples which had been generated using a mixture of CH4, NH3, H2S and CO2 were collected, catalogued, and stored by Miller, but for unknown reasons were never studied. In our analyses a total of 23 amino acids and 4 amines, including 7 organosulfur compounds, were detected in these samples. The major amino acids with chiral centers are racemic within the accuracy of the measurements, indicating that they are not contaminants introduced during sample storage. This experiment marks the first synthesis of sulfur amino acids from spark discharge experiments designed to imitate primordial environments. The relative yield of some amino acids, in particular the isomers of amino butyric acid, are the highest ever found in a spark discharge experiment. The simulated primordial conditions used by Miller in these experiments may serve as a model for early volcanic plume chemistry and provide insight to the possible roles such plumes may have played in abiotic organic synthesis. Additionally, the overall abundances of the synthesized amino acids in the presence of H2S are very similar to the abundances found in some carbonaceous meteorites, suggesting that H2S may have played an important role in prebiotic reactions in early solar system environments. Although experiments using a variety of gases as components of the primordial Earth's atmospheric composition and a spark discharge apparatus configured according to Miller's original or volcanic design can be readily carried out, the unique opportunity to investigate samples prepared by the pioneer in abiotic synthesis using state of the art analytical methods is of considerable historic interest.

Parker, Eric T.↗
NASA NTRS2023

The Eruption of a Magnetic Flux Rope Observed By Solar Orbiter and Parker Solar Probe

Magnetic flux ropes are a key component of coronal mass ejections, forming the core of these eruptive phenomena. However, determining whether a flux rope is present prior to eruption onset and, if so, the rope’s handedness and the number of turns that any helical field lines make is difficult without magnetic field modelling or in-situ detection of the flux rope. We present two distinct observations of plasma flows along a filament channel on 4 and 5 September 2022 made using the Solar Orbiter spacecraft. Each plasma flow exhibited helical motions in a right-handed sense as the plasma moved from the source active region across the solar disk to the quiet Sun, suggesting that the magnetic configuration of the filament channel contains a flux rope with positive chirality and at least one turn. The length and velocity of the plasma flow increased from the first to the second observation, suggesting evolution of the flux rope, with the flux rope subsequently erupting within ∼5 hours of the second plasma flow. The erupting flux rope then passed over the Parker Solar Probe spacecraft during its Encounter 13, enabling in-situ diagnostics of the structure. Although complex and consistent with the flux rope erupting from underneath the heliospheric current sheet, the in-situ measurements support the inference of a right-handed flux rope from remote-sensing observations. These observations provide a unique insight into the eruption and evolution of a magnetic flux rope near the Sun.

Dynamics↗
DOE OSTI2025

Emergent Inductance from Chiral Orbital Currents in a Bulk Ferrimagnet

Here, we report the discovery of a new form of inductance in the bulk ferrimagnet Mn 3 ⁢Si 2 ⁢Te 6 , which features strong spin-orbit coupling, large magnetic anisotropy, and pronounced magnetoelastic interactions. Below its Curie temperature (𝑇 𝐶 ≈ 78 K), Mn 3 ⁢Si 2 ⁢Te 6 hosts chiral orbital currents (COC) that circulate within the crystal lattice and give rise to collective electronic behavior [Control of chiral orbital currents in a colossal magnetoresistance material, Nature (London) 611, 467 (2022).]. By applying a magnetic field along the hard 𝑐 axis and driving the system with low-frequency currents, we uncover a giant inductive response up to millhenry scale, originating from first-order reconfigurations of COC domains. These domains act as coherent mesoscopic inductive elements that resist reversal upon current reduction, producing a large electromotive force and sharply increasing voltage. This emergent inductance defies classical models, occurs without superconductivity or engineered nanostructures, and opens a new frontier in orbital-based quantum functionality and device concepts.

complex materials↗
DOE OSTI2024

DNA-mediated assembly of Au bipyramids into anisotropic light emitting kagome superlattices

Colloidal crystal engineering with DNA allows one to design diverse superlattices with tunable lattice symmetry, composition, and spacing. Most of these structures follow the complementary contact model, maximizing DNA hybridization on building blocks and producing relatively close-packed lattices. Here, low-symmetry kagome superlattices are assembled from DNA-modified gold bipyramids that can engage only in partial DNA surface matching. The bipyramid dimensions and DNA length can be engineered for two different superlattices with rhombohedral unit cells, including one composed of a periodic stacking of kagome lattices. Enabled by the partial facet alignment, the kagome lattices exhibit lattice distortion, bipyramid twisting, and planar chirality. When conjugated with Cy-5 dyes, the kagome lattices serve as cavities with high-density optical states and large Purcell factors along lateral directions, leading to strong dipole radiation along thezaxis and facet-dependent light emission. Such complex optical properties make these materials attractive for lasers, displays, and quantum sensing constructs.

Science & Technology - Other Topics↗
DOE OSTI2026

Machine-learning force-field models for dynamical simulations of metallic magnets

We review recent advances in machine-learning (ML) force-field methods for Landau–Lifshitz–Gilbert simulations of itinerant electron magnets, focusing on their scalability and transferability. Built on the principle of locality, a deep neural-network model is developed to efficiently and accurately predict electron-mediated forces governing spin dynamics. Symmetry-aware descriptors constructed through a group-theoretical approach ensure rigorous incorporation of both lattice and spin-rotation symmetries. The framework is demonstrated using the prototypical s-d exchange model widely employed in spintronics. ML-enabled large-scale simulations reveal novel nonequilibrium phenomena, including anomalous coarsening of tetrahedral spin order on the triangular lattice and the freezing of phase-separation dynamics in lightly hole-doped, strong-coupling square-lattice systems. These results establish ML force-field frameworks as scalable, accurate, and versatile tools for modeling nonequilibrium spin dynamics in itinerant magnets.

Artificial neural networks↗
DOE OSTI2026

Spontaneous Twirls and Structural Frustration in Moiré Materials

Structural twirls form spontaneously in the domain wall networks of some moiré materials. We show that in heterobilayers, neighboring twirl chiralities tend to antialign, forming staggered patterns that are well described by antiferromagnetic lattice 𝜙 4 theories. In moiré systems with triangular domains, this leads to frustration in the chirality configuration of the twirls and to hysteresis with respect to variation of the average twist angle and possibly other control parameters. As a result, we expect that in typical materials, the ordering temperature of twirls is about 10 3 K, and that thermal fluctuations in individual twirl chiralities freeze below room temperature.

Elastic deformation↗
DOE OSTI2024

Mechanisms in the Synthesis of S -Alcohols with 1,4-NADH Biomimetic Co-factor N-Benzyl-1,4-dihydronicotinamide using Horse Liver Alcohol Dehydrogenase: A Hybrid Computational Study

The enantioselective reduction of prochiral ketones catalyzed by horse liver alcohol dehydrogenase (HLADH), was investigated via a hybrid computational approach, for molecular reactions involved in chiral synthesis of S-alcohols, when the natural co-factor, 1,4-dihyronicotinamide adenine dinucleotide, 1,4-NADH, was replaced with biomimetic co-factor, N-benzyl-1,4-dihydronicotinamide, 1. We surmised that different hydride and proton transfer mechanisms were involved using co-factor, 1. An alternative mechanism, where the hydride transfer step occurred, via an η 1 -keto-S-η 2 -5,6-1,4-dihydronicotinamide-Zn(II) complex, was previously investigated with a model of the HLADH-Zn(II) catalytic site (J. Organometal. Chem. 2021, 943, 121810). Presently, we studied canonical and alternative mechanisms compared to models of the entire enzyme structure. We disproved the η 2 -Zn(II) complex, and discovered a canonical hydride transfer from biomimetic 1,4-NADH, 1, to the Zn(II) bound prochiral ketone substrate, followed by a new proton relay, consisting of a water chain connecting His51 to Ser48 that accomplished the S-alkoxy anion's protonation to yield the final S-alcohol product. The HLADH catalysis, with biomimetic co-factor, 1, that replaced the ribose group, the 5'-diphosphate groups, and the adenine nucleotide with a N-benzyl group, has provided a new paradigm for the design of other structures of 1,4-NADH biomimetic co-factors, including their economic value in biocatalysis reactions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Enantioselective Hydrodifluoroalkylation of Alkenes with Conformationally Tuned Peptidyl Hydrogen Atom Transfer Catalysts

Here, we report the enantioselective hydrodifluoroalkylation of alkenes proceeding via an asymmetric hydrogen atom transfer (HAT) event catalyzed by thiol-containing tetrapeptides. Photocatalytic generation of a difluoroacetyl radical followed by carbon–carbon bond formation results in a prochiral carbon-centered radical that engages with the chiral catalyst. A trialkylamine reductant is proposed to turn over the catalyst in this net-reductive transformation. Notably, incorporating an (S)-β-methyl-substituted cysteine as the N-terminal residue improved selectivity relative to that of the native N-terminal cysteine (Cys) residue, and X-ray crystallographic analysis supports the conformational underpinning of this effect. A range of enantioenriched γ-substituted amides were synthesized in up to a 96:4 enantiomeric ratio, demonstrating the broad functional group tolerance of this method. Models accounting for asymmetric induction are proposed with supporting DFT calculations.

08 HYDROGEN↗