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At least 1,405 records · Page 78

M06-SX screened-exchange density functional for chemistry and solid-state physics

Significance Density functionals with Hartree–Fock exchange have been widely used for a wide range of chemical applications, but the nonlocal character of exchange makes long-range exchange computationally expensive for solid-state calculations with periodic boundary conditions, and full exchange is nonphysical for condensed-phase systems. Here, we present a screened-exchange (SX) density functional, M06-SX, that is especially designed to have good accuracy for both solid-state physics and chemical applications with less computational cost than full Hartree–Fock exchange. The M06-SX functional gives accuracy comparable to functionals with full Hartree–Fock exchange for predicting chemical properties of molecules, while also being practical with good accuracy for plane wave calculations on band gaps and lattice constants of solids.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Holography of the photon ring

Space-based next-generation interferometers propose to measure the Lyapunov exponents of the nearly bound geodesics that comprise the photon ring surrounding the black hole M87*. We argue that these classical Lyapunov exponents equal the quantum Ruelle resonances describing the late-time approach to thermal equilibrium of the quantum microstate holographically dual to any Kerr black hole such as M87*. Moreover, we identify 'near-ring regions' in the phase space of fields propagating on Kerr that exhibit critical behavior, including emergent conformal symmetries. These are analogues for sub-extremal Kerr of the much-studied 'near-horizon regions' of (near-)extremal black holes. Here, the emergent conformal symmetries greatly constrain the observational predictions for the fine photon ring substructure around M87* and for quasinormal gravitational-wave ringdowns, as well as any proposal for a quantum holographic dual to the Kerr black hole. More generally, we hope that our identification of several universal features of Kerr spectroscopy provides a useful starting point for a bottom-up approach to holography for astrophysical black holes.

79 ASTRONOMY AND ASTROPHYSICS↗

Limited modified gravity

In this work, we systematically assess several limiting cases of modified gravity, where particular theoretical or observational conditions hold. This framework includes the well known scalar-tensor gravity and No Slip Gravity and No Run Gravity, and we extend it to three new limits: only Run, Only Light, and Only Growth Gravities. These limits give simplifications that allow deeper understanding of modified gravity, including demonstration that gravitational effects on light and matter can have opposite signs in their deviation from general relativity. We also show observational predictions for the different cosmic structure growth rates fσ8 and the ratio of gravitational wave standard siren luminosity to photon standard candle luminosity distance relations, defining a new statistic DG that emphasizes their complementarity and ability to distinguish models.

79 ASTRONOMY AND ASTROPHYSICS↗

Magnetic excitations affected by spin-lattice coupling in the S=3/2 triangular lattice antiferromagnet Ag 2 CrO 2

Ag 2 CrO 2 is an S=3/2 triangular lattice antiferromagnet in which long-range magnetic order with a fivefold magnetic unit cell appears below the transition temperature (T N ) of 24 K. The long-range magnetic order is accompanied by a structural transition. Inelastic neutron scattering experiments were performed to investigate the magnetic interactions, anisotropy, and correlations in this material. Above T N , diffuse scattering originating from the short-ranged magnetic correlations consistent with a 120° structure was observed. Here, the magnetic excitations below T N were reproduced reasonably well using a linear spin-wave model with further-neighbor interactions and easy-axis anisotropy, which are predicted to be due to a previously proposed spin-lattice coupling.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Anomalous Hall crystals in rhombohedral multilayer graphene. II. General mechanism and a minimal model

Here we propose a minimal "three-patch model"for the anomalous Hall crystal (AHC), a topological electronic state that spontaneously breaks both time-reversal symmetry and continuous translation symmetry. The proposal for this state is inspired by the recently observed integer and fractional quantum Hall states in rhombohedral multilayer graphene at zero magnetic field. There, interaction effects appear to amplify the effects of a weak moiré potential, leading to the formation of stable, isolated Chern bands. It has been further shown that Chern bands are stabilized in mean-field calculations even without a moiré potential, enabling a realization of the AHC state. Our model is built on the dissection of the Brillouin zone into patches centered around high-symmetry points. Within this model, the wave functions at high-symmetry points fully determine the topology and energetics of the state. We extract two quantum geometrical phases of the noninteracting wave functions that control the stability of the topologically nontrivial AHC state. The model predicts that the AHC state wins over the topological trivial Wigner crystal in a wide range of parameters, and agrees very well with the results of full self-consistent Hartree-Fock calculations of the rhombohedral multilayer graphene Hamiltonian.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Computer program for analysis of coupled-cavity traveling wave tubes

A flexible, accurate, large signal computer program was developed for the design of coupled cavity traveling wave tubes. The program is written in FORTRAN IV for an IBM 360/67 time sharing system. The beam is described by a disk model and the slow wave structure by a sequence of cavities, or cells. The computational approach is arranged so that each cavity may have geometrical or electrical parameters different from those of its neighbors. This allows the program user to simulate a tube of almost arbitrary complexity. Input and output couplers, severs, complicated velocity tapers, and other features peculiar to one or a few cavities may be modeled by a correct choice of input data. The beam-wave interaction is handled by an approach in which the radio frequency fields are expanded in solutions to the transverse magnetic wave equation. All significant space harmonics are retained. The program was used to perform a design study of the traveling-wave tube developed for the Communications Technology Satellite. Good agreement was obtained between the predictions of the program and the measured performance of the flight tube.

Connolly, D. J.↗

Nonlinear Alfven waves in high-speed solar wind streams

A nonlinear proton distribution function that is an exact stationary solution of the nonlinear Vlasov equation and Maxwell's equations and which supports a single nonlinear transverse Alfven (ion cyclotron) wave that is circularly polarized and nondispersive is proposed for most of the observations during high-speed solar wind streams. This nonlinear distribution removes the strong Alfven wave instability, inconsistent with the persistence of the observed proton distribution functions in high-speed streams, found by the linear stability analysis. Model temperature anisotropies and drift velocities of the two spatially inhomogeneous bi-Maxwellian components are consistent with typical proton velocity distributions measured in high-speed streams at 1 AU. Two derived relations for each of the wave number and the phase velocity of the wave are obeyed within experimental uncertainties by two typical proton measurements. Our model also predicts that the alpha particle bulk flow velocity exceeds the proton particle bulk flow velocity, as is observed.

Abraham-Shrauner, B.↗

Effects of D region ionization on radio wave propagation

The effects of anomalous D region ionization upon radio wave propagation are described for the main types of disturbances: sudden ionospheric disturbances, relativistic electron events, magnetic storms, auroral disturbances, polar cap events, and stratospheric warmings. Examples of radio wave characteristics for such conditions are given for the frequencies between the extremely low (3-3000 Hz) and high (3-30 MHz) frequency domains. Statistics on the disturbance effects and radio wave data are given in order to contribute towards the evaluation of possibilities for predicting the radio effects.

Larsen, T. R.↗

The plumes of Titan

The plasma density enhancements observed during the Voyager 1 Titan encounter are interpreted in terms of a single plume of plasma wrapped around Saturn by corotation. Consideration is given to the radial motions of the plume driven by fluctuations in solar wind pressure and the dispersal of the plasma by the centrifugal interchange instability, by heating, and by azimuthal acceleration. It is shown that Saturn cannot readily impose corotation directly on the plume and, incidentally, that the total dissipation associated with the Titan-magnetosphere interaction is insufficient to supply the power to produce the observed Titan ultraviolet airglow. A pickup velocity of 8 km/s is inferred on the basis of the observed velocity and a standing wave model. It is found that the Voyager plasma observations are consistent with the predictions of the model.

Eviatar, A.↗

Millimeter wave satellite communication studies. Results of the 1981 propagation modeling effort

Theoretical modeling associated with rain effects on millimeter wave propagation is detailed. Three areas of work are discussed. A simple model for prediction of rain attenuation is developed and evaluated. A method for computing scattering from single rain drops is presented. A complete multiple scattering model is described which permits accurate calculation of the effects on dual polarized signals passing through rain.

Stutzman, W. L.↗

Eikonal phase shift analyses of carbon-carbon scattering

A high-energy double-folding optical potential approximation to the exact nucleus-nucleus multiple-scattering series is used in determining eikonal phase shifts for carbon-carbon scattering at 204.2, 242.7, and 288.6 MeV. The double-folding potentials are derived by folding the energy-dependent free nucleon-nucleon interaction with densities for the projectile and target; these latter are obtained by unfolding the finite nucleon charge density from harmonic-well carbon charge distributions. The charge parameters for these distributions are taken from the results of electron scattering experiments. Predictions are made for total, reaction, and elastic differential cross sections using standard partial wave analysis for the scattering of identical particles and are then compared with recent experimental results. Excellent agreement is obtained despite the absence of arbitrarily adjusted parameters in the theory.

Townsend, L. W.↗

A comparative study of plasma heating by ion acoustic and modified two-stream instabilities at subcritical quasi-perpendicular shocks

Plasma heating due to the ion acoustic instability and the modified two-stream instability is examined for quasi-perpendicular subcritical shocks. Electron and ion heating is investigated as a function of upstream electron to ion temperature ratio and plasma beta using second-order heating rates. A simple shock model is employed in which the cross-field electron-ion drift speed is adjusted until the total (adiabatic plus anomalous) heating matches that required by the Rankine-Hugoniot relations. Quantities such as the width of the shock and the maximum electric field fluctuations are also calculated, and the results are compared with the ISEE data set of subcritical bow shock crossings. The observed width of the shock, the amount of plasma heating, and the low-frequency electric field intensity are in reasonably good agreement with the calculations for the modified two-stream instability. On the other hand, the wave intensities at higher frequency are about 4 orders of magnitude smaller than those predicted for the ion acoustic instability at saturation, consistent with the fact that the measured shock widths imply cross-field drift speeds that are below threshold for this instability. It is therefore concluded that the dissipation at these shocks is most likely due to the lowest frequency, modified two-stream instability.

Winske, D.↗

Cavitation effects on the pressure distribution of a squeeze film damper bearing

High speed motion pictures have revealed several operating regimes in a squeeze film damper. Pressure measurements corresponding to these distinct regimes were made to examine their effect on the performance of such dampers. Visual observation also revealed the means by which the pressure in the feed groove showed higher amplitudes than the theory predicts. Comparison between vapor and gaseous cavitation are made based on their characteristic pressure wave, and the effect this has on the total force and its phase.

Zeidan, Fouad Y.↗

Numerical simulation of cloud and precipitation structure during GALE IOP-2

A regional scale model, LAMPS (Limited Area Mesoscale Prediction System), is used to investigate cloud and precipitation structure that accompanied a short wave system during a portion of GALE IOP-2. A comparison of satellite imagery and model fields indicates that much of the large mesoscale organization of condensation has been captured by the simulation. In addition to reproducing a realistic phasing of two baroclinic zones associated with a split cold front, a reasonable simulation of the gross mesoscale cloud distribution has been achieved.

Robertson, F. R.↗

Tone generation by aeroacoustic sources in pipes with flow

Sound production by axisymmetric ring cavities in internal flow has been investigated experimentally. These ring sources generate sound when the acoustic motion in the cavity is in resonance in one of many possible modes. Experimental results agree with predictions of a model eddy-driven oscillator. It is observed that the standing waves produced by reflections from regions upstream and downstream of the source are adjusted by the source such that the source is at a pressure antinode at the condition of maximum sound emission.

Shakkottai, P.↗

Force-free electromagnetic pulses in a laboratory plasma

A short, intense current pulse is drawn from an electrode immersed in a magnetized afterglow plasma. The induced magnetic field B(r,t) assumes the shape of a helical double vortex which propagates along B(0) through the uniform plasma as a whistler mode. The observations support a prediction of force-free (J x B + neE = 0) electromagnetic fields and solitary waves. Energy and helicity are approximately conserved.

Stenzel, R. L.↗

Theory of instability and transition

The strongly nonlinear area of theory is discussed, as well as linear and weakly nonlinear (i.e., perturbation) theories, and it is noted that the weaknesses of the weakly nonlinear theory are essentially the inappropriate formulation in earlier works and the lack of guidance for the choice of the lowest-order basis. Attention is focused on the areas of theoretical/numerical development contributing to understanding the transition mechanism and new means for analyzing and predicting transition quantitatively. The nonlinear stability of nonparallel flows, linear secondary instability, and nonlinear wave interaction are analyzed. The incompressible flow over a flat plate with zero-pressure gradient is chosen as an example, while applications range to other shear flows including three-dimensional and compressible boundary layers.

Herbert, Thorwald↗

The utilization of satellite observed total ozone to predict tropical cyclone recurvature

The feasibility of using satellite measurements of total ozone to delineate the characteristic upper-tropospheric wave patterns conductive for tropical cyclone recurvature was investigated using measurements by the Nimbus-7 TOMS instrument measurements of total ozone fields were used to delineate the total ozone distribution for the straight-moving, left-curving, and right-curving tropical cyclones. Using these data for 12-h and 24-h forecasts, it is shown that the composite total ozone maps could be used to differentiate the recurving tropical cyclones from nonrecurving systems, suggesting that the majority of the upper-tropospheric waves delineated by total ozone distribution were deep enough to influence the motion of the storms. The left- and the right-recurving tropical cyclones observed during the 12-hr and 24-hr periods had, respectively, higher and lower upper-tropospheric heights downstream than the nonrecurving cyclones.

Rodgers, Edward B.↗