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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 91 records · Page 5
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Spin-mediated shear oscillators in a van der Waals antiferromagnet

Understanding how microscopic spin configuration gives rise to exotic properties at the macroscopic length scale has long been pursued in magnetic materials. One seminal example is the Einstein-de Haas effect in ferromagnets, in which angular momentum of spins can be converted into mechanical rotation of an entire object. However, for antiferromagnets without net magnetic moment, how spin ordering couples to macroscopic movement remains elusive. Here we observed a seesaw-like rotation of reciprocal lattice peaks of an antiferromagnetic nanolayer film, whose gigahertz structural resonance exhibits more than an order-of-magnitude amplification after cooling below the Neel temperature. Using a suite of ultrafast diffraction and microscopy techniques, we directly visualize this spin-driven rotation in reciprocal space at the nanoscale. This motion corresponds to interlayer shear in real space, in which individual micro-patches of the film behave as coherent oscillators that are phase-locked and shear along the same in-plane axis. Using time-resolved optical polarimetry, we further show that the enhanced mechanical response strongly correlates with ultrafast demagnetization, which releases elastic energy stored in local strain gradients to drive the oscillators. Finally, our work not only offers the first microscopic view of spin-mediated mechanical motion of an antiferromagnet but it also identifies a new route towards realizing high-frequency resonators up to the millimetre band, so the capability of controlling magnetic states on the ultrafast timescale can be readily transferred to engineering the mechanical properties of nanodevices.

36 MATERIALS SCIENCE↗
DOE OSTI2025

Electron correlation and relativistic effects in the excited states of radium monofluoride

Highly accurate and precise electronic structure calculations of heavy radioactive atoms and their molecules are important for several research areas, including chemical, nuclear, and particle physics. Ab initio quantum chemistry can elucidate structural details in these systems that emerge from the interplay of relativistic and electron correlation effects, but the large number of electrons complicates the calculations, and the scarcity of experiments prevents insightful theory-experiment comparisons. Here we report the spectroscopy of the 14 lowest excited electronic states in the radioactive molecule radium monofluoride (RaF), which is proposed as a sensitive probe for searches of new physics. The observed excitation energies are compared with state-of-the-art relativistic Fock-space coupled cluster calculations, which achieve an agreement of ≥99.64% (within ~12 meV) with experiment for all states. Guided by theory, a firm assignment of the angular momentum and term symbol is made for 10 states and a tentative assignment for 4 states. The role of high-order electron correlation and quantum electrodynamics effects in the excitation energies is studied and found to be important for all states.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2020

Many-Body Dynamical Localization in a Kicked Lieb-Liniger Gas

The kicked rotor system is a textbook example of how classical and quantum dynamics can drastically differ. The energy of a classical particle confined to a ring and kicked periodically will increase linearly in time whereas in the quantum version the energy saturates after a finite number of kicks. The quantum system undergoes Anderson localization in angular-momentum space. Conventional wisdom says that in a many-particle system with short-range interactions the localization will be destroyed due to the coupling of widely separated momentum states. Here we provide evidence that for an interacting one-dimensional Bose gas, the Lieb-Liniger model, the dynamical localization can persist at least for an unexpectedly long time.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Anisotropic angular scattering models of elastic electron-neutral collisions for Monte Carlo plasma simulations

Many laboratory and industrial plasma applications require accurate modeling techniques to understand the interplay between microscopic and macroscopic processes. A prime example of this interplay is how particle and Monte Carlo (MC) simulation codes describe angular scattering of electrons following elastic scattering events. The forward peaked nature of high energy electron elastic scattering is relatively trivial to accurately describe in plasma simulations. However, for lower energy collisions, which produce near isotropic or backward peaked differential cross sections, there is not a strong consensus among the plasma modeling community on how to best describe these angular scattering trends. Here, in this study, we propose a systematic method to approximate the aforementioned non-trivial angular scattering behavior with a formula that can be readily implemented in particle-in-cell (PIC) and/or MC plasma simulation codes. The present approach is specifically applied to fusion relevant atomic hydrogen and helium, as well as for molecular hydrogen, and results are also applicable to the atomic isotopes and homonuclear molecular isotopologues of these species. Comparisons between the present angular distribution function and benchmark scattering data were used to validate the proposed models. In addition, two-term Boltzmann calculations and PIC direct simulation MC simulations revealed that the proposed angular distribution function is accurate, agreeing very well with benchmark convergent close-coupling scattering calculations, and electron transport measurements. These studies confirmed that the present angular distribution function model can be utilized without the need of renormalization to the momentum transfer cross section (as opposed to using the elastic scattering integrated cross section), which has been suggested by several studies in order to correct for deficient angular scattering models, and to agree with transport measurements. Hence, the present anisotropic angular scattering model can be utilized to accurately model the momentum transfer as well as the electron trajectories of elastic collisions.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

Fully gauge-fixed SU(2) Hamiltonian for quantum simulations

Here, we demonstrate how to construct a fully gauge-fixed lattice Hamiltonian for a pure SU(2) gauge theory. Our work extends upon previous work, where a formulation of an SU(2) lattice gauge theory was developed that is efficient to simulate at all values of the gauge coupling. That formulation utilized maximal-tree gauge, where all local gauge symmetries are fixed and a residual global gauge symmetry remains. By using the geometric picture of an SU(2) lattice gauge theory as a system of rotating rods, we demonstrate how to fix the remaining global gauge symmetry. In particular, the quantum numbers associated with total charge can be isolated by rotating between the lab and body frames using the three Euler angles. The Hilbert space in this new “sequestered” basis partitions cleanly into sectors with differing total angular momentum, which makes gauge-fixing to a particular total charge sector trivial, particularly for the charge-zero sector. In addition to this sequestered basis inheriting the property of being efficient at all values of the coupling, we show that, despite the global nature of the final gauge-fixing procedure, this Hamiltonian can be simulated using quantum resources scaling only polynomially with the lattice volume.

Lattice gauge theory↗
DOE OSTI2020

Local spin polarizations in relativistic heavy-ion collisions

Here, based on a generalized side-jump formalism for massless chiral fermions, which naturally takes into account the spin-orbit coupling in the scattering of two chiral fermions and the chiral vortical effect in a rotating chiral fermion matter, we have developed a covariant and total-angular-momentum-conserved chiral transport model to study both the global and local polarizations of this matter. For a system of massless quarks of random spin orientations and finite vorticity in a box, we have demonstrated that the model can exactly conserve the total angular momentum of the system and dynamically generate the quark spin polarization expected from a thermally equilibrated quark matter. Using this model to study the spin polarization in relativistic heavy-ion collision, we have found that the local quark spin polarizations depend strongly on the reference frame where they are evaluated as a result of the nontrivial axial charge distribution caused by the chiral vortical effect. We have further shown that because of the anomalous orbital or side-jump contribution to the quark spin polarization, the local quark polarizations calculated in the medium rest frame are qualitatively consistent with the local polarizations of Lambda hyperons measured in experiments.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2023

Evolution of Bose–Einstein condensate systems beyond the Gross–Pitaevskii equation

While many phenomena in cold atoms and other Bose–Einstein condensate (BEC) systems are often described using the mean-field approaches, understanding the kinetics of BECs requires the inclusion of particle scattering via the collision integral of the quantum Boltzmann equation. A rigorous approach for many problems in the dynamics of the BEC, such as the nucleation of the condensate or the decay of the persistent current, requires, in the presence of factors making a symmetry breaking possible, considering collisions with thermal atoms via the collision integral. These collisions permit the emergence of vorticity or other signatures of long-range order in the nucleation of the BEC or the transfer of angular momentum to thermal atoms in the decay of persistent current, due to corresponding terms in system Hamiltonians. Here, we also discuss the kinetics of spin–orbit-coupled BEC. The kinetic equation for the particle spin density matrix is derived. Numerical simulations demonstrate significant effects of the collision integral on the dynamics of the spin–orbit-coupled BEC upon quenching of the Raman coupling that generates synthetic electric and magnetic fields.

Bose–Einstein condensation↗
DOE OSTI2020

Measurement of top quark pair production in association with a Z boson in proton-proton collisions at s$$ \sqrt{\mathrm{s}} $$ = 13 TeV

A measurement of the inclusive cross section of top quark pair production in association with a Z boson using proton-proton collisions at a center-of-mass energy of 13 TeV at the LHC is performed. The data sample corresponds to an integrated luminosity of 77.5 fb$^{-1}$, collected by the CMS experiment during 2016 and 2017. The measurement is performed using final states containing three or four charged leptons (electrons or muons), and the Z boson is detected through its decay to an oppositely charged lepton pair. The production cross section is measured to be σ($ \mathrm{t}\overline{\mathrm{t}}\mathrm{Z} $) = 0.95 ± 0.05 (stat) ± 0.06 (syst) pb. For the first time, differential cross sections are measured as functions of the transverse momentum of the Z boson and the angular distribution of the negatively charged lepton from the Z boson decay. The most stringent direct limits to date on the anomalous couplings of the top quark to the Z boson are presented, including constraints on the Wilson coefficients in the framework of the standard model effective field theory.[graphic not available: see fulltext]

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

Light control of intramolecular nuclear dynamics by vortex electron localization

In strong-field ionization of molecules, intense light pulses are thought to have a negligible direct influence on atomic nuclei. Molecular dissociation is thus expected to be determined by the geometrical configuration of the molecular ion at the ionization instant. Contrary to this picture, we observe a counterintuitive electron-proton angular correlation and the formation of proton vortices following strong-field ionization of H 2 molecules by bicircularly polarized two-color laser fields. We explain this phenomenon by the pathway interference and localization of the residual H 2 ⁡+ electron in different angular-momentum states formed in the tail of the driving laser pulse. We validate this interpretation by combining a quantum-mechanical numerical simulation of the field-driven coupled electronic-nuclear dynamics and a semiclassical-trajectory model for the phase accumulation of the laser-driven electronic-nuclear wave packet. Our joint experimental and theoretical study reveals a general picture of vortex electron localization which can be used for controlling molecular-bond breaking with circularly polarized laser fields.

Atomic & molecular processes in external fields↗
DOE OSTI2020

The role of rotation-vibration coupling in symmetric and asymmetric isotopomers of ozone

A theoretical framework and a computer code (SpectrumSDT) are developed for accurate calculations of coupled rotational–vibrational states in triatomic molecules using hyper-spherical coordinates and taking into account the Coriolis coupling effect. Concise final formulas are derived for the construction of the Hamiltonian matrix using an efficient combination of the variational basis representation and discrete variable representation methods with locally optimized basis sets and grids. First, the new code is tested by comparing its results with those of the APH3D program of Kendrick et al. [Kendrick, Pack, Walker, and Hayes, J. Chem. Phys. 110, 6673 (1999)]. Then, accurate calculations of the rovibrational spectra are carried out for doubly substituted symmetric ( 18 O 16 O 18 O) and asymmetric ( 18 O 18 O 16 O) ozone isotopomers for the total angular momentum up to J = 5. Together with similar data recently reported for the singly substituted symmetric ( 16 O 18 O 16 O) and asymmetric ( 16 O 16 O 18 O) ozone isotopomers, these calculations quantify the role of the Coriolis coupling effect in the large mass-independent isotopic enrichment of ozone, observed in both laboratory experiments and the atmosphere of the Earth. It is found that the Coriolis effect in ozone is relatively small, as evidenced by deviations of its rotational constants from the symmetric-top-rotor behavior, magnitudes of parity splittings (Λ-doubling), and ratios of rovibrational partition functions for asymmetric vs symmetric ozone molecules. It is concluded that all of these characteristics are influenced by the isotopic masses as much as they are influenced by the overall symmetry of the molecule. It is therefore unlikely that the Coriolis coupling effect could be responsible for symmetry-driven mass-independent fractionation of oxygen isotopes in ozone.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Strongly Interacting Matter Under Rotation: An Introduction

Ultrarelativistic collisions between heavy nuclei briefly generate the quark-gluon plasma (QGP), a new state of matter characterized by deconfined par- tons last seen microseconds after the Big Bang. The properties of the QGP are of intense interest, and a large community has developed over several decades, to pro- duce, measure and understand this primordial plasma. The plasma is now recog- nized to be a strongly-coupled fluid with remarkable properties, and hydrodynamics is commonly used to quantify and model the system. An important feature of any fluid is its vorticity, related to the local angular momentum density; however, this degree of freedom has received relatively little attention because no experimental signals of vorticity had been detected. Thanks to recent high-statistics datasets from experiments with precision tracking and complete kinemetic coverage at collider energies, hyperon spin polarization measurements have begun to uncover the vor- ticity of the QGP created at the Relativistic Heavy Ion Collider. The injection of this new degree of freedom into a relatively mature field of research represents an enormous opportunity to generate new insights into the physics of the QGP. The community has responded with enthusiasm, and this book (to be published as a volume of Lecture Notes in Physics series by Springer) represents some of the diverse lines of inquiry into aspects of strongly interacting matter under rotation

Becattini, Francesco↗
DOE OSTI2024

Designing phase sensitive probes of monopole superconducting order

Distinct from familiar s-, p-, or d-wave pairings, the monopole superconducting order represents a novel class of pairing order arising from nontrivial monopole charge of the Cooper pair. In the weak-coupling regime, this order can emerge when pairing occurs between Fermi surfaces with different Chern numbers in, for example, doped Weyl semimetal systems. However, the phase of monopole pairing order is not well-defined over an entire Fermi surface, making it challenging to design experiments sensitive to both its symmetry and topology. To address this, we propose a scheme based on symmetry and topological principles to identify this elusive pairing order through a set of phase-sensitive Josephson experiments. By examining the discrepancy between global and local angular momentum of the pairing order, we can unveil the monopole charge of the pairing order, including for models with higher pair monopole charge |q p |=1,2, and 3. We demonstrate the proposed probe of monopole pairing order through analytic and numerical studies of Josephson coupling in models of monopole superconductor junctions. This work opens a promising avenue to uncover the unique topological properties of monopole pairing orders and to distinguish them from known pairing orders based on spherical harmonic symmetry.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Phonon Helicity Induced by Electronic Berry Curvature in Dirac Materials

In two-dimensional insulators with time-reversal (TR) symmetry, a nonzero local Berry curvature of low-energy massive Dirac fermions can give rise to nontrivial spin and charge responses, even though the integral of the Berry curvature over all occupied states is zero. In this Letter, we present a new effect induced by the electronic Berry curvature. By studying electron-phonon interactions in BaMnSb2, a prototype two-dimensional Dirac material possessing two TR-related massive Dirac cones, we find that the nonzero local Berry curvature of electrons can induce a phonon angular momentum. The direction of this phonon angular momentum is locked to the phonon propagation direction, and thus we refer to it as “phonon helicity” in a way that is reminiscent of electron helicity in spin-orbit-coupled electronic systems. We discuss possible experimental probes of such phonon helicity.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Stroboscopic x-ray diffraction microscopy of dynamic strain in diamond thin-film bulk acoustic resonators for quantum control of nitrogen-vacancy centers

Bulk-mode acoustic waves in a crystalline material exert lattice strain through the thickness of the sample, which couples to the spin Hamiltonian of defect-based qubits such as the nitrogen-vacancy (N-V) center defect in diamond. This mechanism has previously been harnessed for unconventional quantum spin control, spin decoherence protection, and quantum sensing. Bulk-mode acoustic wave devices are also important in the microelectronics industry as microwave filters. A key challenge in both applications is a lack of appropriate operando microscopy tools for quantifying and visualizing gigahertz-frequency dynamic strain. Here, in this work, we directly image acoustic strain within N-V center-coupled diamond thin-film bulk acoustic wave resonators using stroboscopic scanning hard x-ray diffraction microscopy at the Advanced Photon Source. The far-field scattering patterns of the nanofocused x-ray diffraction encode strain information entirely through the illuminated thickness of the resonator. These patterns have a real-space spatial variation that is consistent with the bulk strain’s expected modal distribution and a momentum-space angular variation from which the strain amplitude can be quantitatively deduced. We also perform optical measurements of strain-driven Rabi precession of of the N-V center spin ensemble, providing an additional quantitative measurement of the strain amplitude. As a result, we directly measure one of the six N-V spin-stress coupling parameters, 𝑏 =2.73⁢(2) MHz/GPa, by correlating these measurements at the same spatial position and applied microwave power. Our results demonstrate a unique technique for directly imaging ac lattice strain in micromechanical structures and provide a direct measurement of a fundamental constant for the N-V center defect spin Hamiltonian.

acoustic techniques↗
DOE OSTI2020

Design and Analysis of a Halo-Measurement Diagnostics

A large dynamical-range diagnostics (LDRD) design at Jefferson Lab will be used at the FAST-IOTA injector to measure the transverse distribution of halo associated with a high-charge electron beam. One important aspect of this work is to explore the halo distribution when the beam has significant angular momentum (i.e. is magnetized). The beam distribution is measured by recording radiation produced as the beam impinges a YAG:Ce screen. The optical radiation is split with a fraction directed to a charged-couple device (CCD) camera. The other part of the radiation is reflected by a digital micromirror device (DMD) that masks the core of the beam distribution. Combining the images recorded by the two cameras provides a measurement of the transverse distribution with over a large dynamical range. The design and analysis of the optical system will be discussed including optical simulation using SRW and the result of a mockup experiment to test the performances of the system will be presented.

43 PARTICLE ACCELERATORS↗
DOE OSTI2024

Orbital angular momentum small- x evolution: exact results in the large- N c limit

We construct an exact solution to the revised small-x orbital angular momentum (OAM) evolution equations derived in [1], based on an earlier work [2]. These equations are derived in the double logarithmic approximation (summing powers of α s ln 2 (1/x) with α s the strong coupling constant and x the Bjorken x variable) and the large-N c limit, with N c the number of quark colors. From our solution, we extract the small-x, large-N c expressions of the quark and gluon OAM distributions.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2021

Open giant magnons on LLM geometries

We compute sigma model solutions for rigidly rotating open strings suspended between giant gravitons in general LLM geometries. These solutions are confined to the LLM plane. These all have a dispersion relation for Δ - J that is consistent with saturation of a BPS bound of the centrally extended spin chain. For the special case of circularly symmetric LLM geometries, we can further evaluate the amount of angular momentum J carried by these strings. This quantity diverges for string configurations that try to move between different “coloring regions” in the LLM plane. All of these quantities have a perturbative expansion in the t’Hooft coupling. For the strings suspended between AdS giants, we can compute in field theory the leading result of J carried by the string via an analytic continuation of the SU(2) result, with the help of the Bethe Ansatz for the SL(2) sector. We thus provide additional information on how the radial direction of AdS arises from (open) spin chain calculations.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2021

Turbulence-driven flow dynamics in general axisymmetric toroidal geometry

The present work gives the equations governing the generation of toroidally axisymmetric flows by turbulent Reynolds and Maxwell stresses in finite aspect ratio, general cross section tokamak plasmas. Inclusion of the divergence-free flow constraint in lowest order changes the time scale for evolution of the poloidal flows driven by turbulence by substantial factors. In the pedestal region for present day machines, comparing to earlier cylindrical models, the time scale evaluated using a large aspect ratio circular cross section model can be two orders of magnitude longer while the present, general geometry result can be about one order of magnitude longer. Inclusion of gyroviscosity in the calculation shows that the only lowest order radial velocity fluctuations that enter the problem are those due to fluctuating E×B flows. Toroidal and poloidal flow effects on the toroidally axisymmetric flows are inextricably coupled due to the neoclassical poloidal viscosity. Accordingly, the physics is inherently three dimensional and measurements of all three velocity components are required to obtain the information needed to quantitatively test the theory. The parallel and angular momentum equations for the lowest order, toroidally axisymmetric flows look like radial transport equations when the turbulence is included. The turbulence terms provide the radial transport fluxes. In standard neoclassical theory, the parallel flow equation is local on each flux surface; there is no radial derivative term. However, adding turbulence gives a way, in principle, for radial transport to lead to poloidal flows that deviate from the neoclassical prediction. As a result, the inclusion of the Maxwell stress provides a mechanism for MHD fluctuations to alter the toroidally axisymmetric flows.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗