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At least 739 records · Page 41

Magnetic field-induced intermediate quantum spin liquid with a spinon Fermi surface

The Kitaev model with an applied magnetic field in the H ∥ [ 111 ] direction shows two transitions: from a nonabelian gapped quantum spin liquid (QSL) to a gapless QSL at H c 1 ≃ 0.2 K and a second transition at a higher field H c 2 ≃ 0.35 K to a gapped partially polarized phase, where K is the strength of the Kitaev exchange interaction. We identify the intermediate phase to be a gapless U(1) QSL and determine the spin structure function S ( k ) and the Fermi surface ϵ F S ( k ) of the gapless spinons using the density matrix renormalization group (DMRG) method for large honeycomb clusters. Further calculations of static spin-spin correlations, magnetization, spin susceptibility, and finite temperature-specific heat and entropy corroborate the gapped and gapless nature of the different field-dependent phases. In the intermediate phase, the spin-spin correlations decay as a power law with distance, indicative of a gapless phase.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Role of generic scale invariance in a Mott transition from a U(1) spin-liquid insulator to a Landau Fermi-liquid metal

Highlights: • We look at the role played by generic scale invariance (GSI) in the phase transition between a U(1) spin liquid and a Fermi liquid. • We identify dangerously irrelevant operators in the renormalization group transformation, involved with the GSI. • We highlight novel mean-field dynamics of this Mott quantum criticality, resulting from the GSI. We investigate the role of generic scale invariance in a Mott transition from a U(1) spin-liquid insulator to a Landau Fermi-liquid metal, where there exist massless degrees of freedom in addition to quantum critical fluctuations. Here, the Mott quantum criticality is described by critical charge fluctuations, and additional gapless excitations are U(1) gauge-field fluctuations coupled to a spinon Fermi surface in the spin-liquid state, which turn out to play a central role in the Mott transition. An interesting feature of this problem is that the scaling dimension of effective leading local interactions between critical charge fluctuations differs from that of the coupling constant between U(1) gauge fields and matter-field fluctuations in the presence of a Fermi surface. As a result, there appear dangerously irrelevant operators, which can cause conceptual difficulty in the implementation of renormalization group (RG) transformations. Indeed, we find that the curvature term along the angular direction of the spinon Fermi surface is dangerously irrelevant at this spin-liquid Mott quantum criticality, responsible for divergence of the self-energy correction term in U(1) gauge-field fluctuations. Performing the RG analysis in the one-loop level based on the dimensional regularization method, we reveal that such extremely overdamped dynamics of U(1) gauge-field fluctuations, which originates from the emergent one-dimensional dynamics of spinons, does not cause any renormalization effects to the effective dynamics of both critical charge fluctuations and spinon excitations. However, it turns out that the coupling between U(1) gauge-field fluctuations and both matter-field excitations still persists at this Mott transition, which results in novel mean-field dynamics to explain the nature of the spin-liquid Mott quantum criticality. We discuss physical implications of effective one-dimensional spin dynamics and extremely overdamped gauge dynamics at the Mott quantum criticality.

36 MATERIALS SCIENCE↗

Parametrized equation of state for electron liquids in the Singwi-Tosi-Land-Sjolander aproximation

Results are reported of a theoretical study of an equation of state for electron liquids (one-component plasmas of electrons embedded in a uniform neutralizing background of positive charges), where there is an interplay between the strong Coulomb-coupling effect and the degrees of Fermi degeneracy. Calculations are based on the Singwi-Tosi-Land-Sjolander approximation (1968). The calculated results are parametrized in the form of analytic formulas for the interaction and excess free energies, which are applicable over a wide range of parameters as long as the electrons are in a paramagnetic fluid state. Unlike the present study, earlier studies concentrated on plasmas where the Fermi degeneracy parameter tended either to zero or to infinity, thus excluding many actual plasmas (stellar interiors, heavy planets such as Jupiter, plasmas in projected inertial confinement fusion experiments, and the liquid metals).

Tanaka, S.↗

Toward precision Fermi-liquid theory in two dimensions

The ultracold and weakly coupled Fermi gas in two spatial dimensions is studied in an effective field theory framework. It has long been observed that universal corrections to the energy density to two orders in the interaction strength do not agree with Monte Carlo simulations in the weak-coupling regime. Here, universal corrections to three orders in the interaction strength are obtained, and are shown to provide agreement between theory and simulation. Special consideration is given to the scale ambiguity associated with the nontrivial renormalization of the singular contact interactions. Further, the isotropic superfluid gap is obtained to next-to-leading order, and nonuniversal contributions to the energy density due to effective range effects, p -wave interactions, and three-body forces are computed. Results are compared with precise Monte Carlo simulations of the energy density and the contact in the weakly coupled attractive and repulsive Fermi-liquid regimes. In addition, the known all-orders sum of ladder and ring diagrams is compared with Monte Carlo simulations at weak coupling and beyond.

74 ATOMIC AND MOLECULAR PHYSICS↗

Electron-Nucleus Scattering Process at Intermediate Energy Transfers

Many-body approach to the lepton-nucleus scattering is being tested. Preliminary results containing the 1p1h and {Delta}(1232)h excitations from local Fermi gas are shown. Comparisons are made with the selected inclusive electron scattering data. The importance of the different physical channels is discussed. The main attention is paid to the lepton energy range from about 500 to 2000 MeV, which is crucial for the present T2K and future NOvA neutrino oscillation experiments.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

INTERACTING COSMIC RAYS WITH MOLECULAR CLOUDS: A BREMSSTRAHLUNG ORIGIN OF DIFFUSE HIGH-ENERGY EMISSION FROM THE INNER 2 Degree-Sign Multiplication-Sign 1 Degree-Sign OF THE GALACTIC CENTER

The high-energy activity in the inner few degrees of the Galactic center is traced by diffuse radio, X-ray, and {gamma}-ray emission. The physical relationship between different components of diffuse gas emitting at multiple wavelengths is a focus of this work. We first present radio continuum observations using the Green Bank Telescope and model the nonthermal spectrum in terms of a broken power-law distribution of {approx}GeV electrons emitting synchrotron radiation. We show that the emission detected by Fermi is primarily due to nonthermal bremsstrahlung produced by the population of synchrotron emitting electrons in the GeV energy range interacting with neutral gas. The extrapolation of the electron population measured from radio data to low and high energies can also explain the origin of Fe I 6.4 keV line and diffuse TeV emission, as observed with Suzaku, XMM-Newton, Chandra, and the H.E.S.S. observatories. The inferred physical quantities from modeling multiwavelength emission in the context of bremsstrahlung emission from the inner {approx}300 Multiplication-Sign 120 pc of the Galactic center are constrained to have the cosmic-ray ionization rate {approx}1-10 Multiplication-Sign 10{sup -15} s{sup -1}, molecular gas heating rate elevating the gas temperature to 75-200 K, fractional ionization of molecular gas 10{sup -6}-10{sup -5}, large-scale magnetic field 10-20 {mu}G, the density of diffuse and dense molecular gas {approx}100 and {approx}10{sup 3} cm{sup -3} over 300 pc and 50 pc path lengths, and the variability of Fe I K{alpha} 6.4 keV line emission on yearly timescales. Important implications of our study are that GeV electrons emitting in radio can explain the GeV {gamma}-rays detected by Fermi and that the cosmic-ray irradiation model, like the model of the X-ray irradiation triggered by past activity of Sgr A*, can also explain the origin of the variable 6.4 keV emission from Galactic center molecular clouds.

79 ASTRONOMY AND ASTROPHYSICS↗

Resistivity Minimum in Highly Frustrated Itinerant Magnets

We study here the transport properties of frustrated itinerant magnets comprising localized classical moments, which interact via exchange with the conduction electrons. Strong frustration stabilizes a liquidlike spin state, which extends down to temperatures well below the effective Ruderman-Kittel-Kasuya-Yosida interaction scale. The crossover into this state is characterized by spin structure factor enhancement at wave vectors smaller than twice the Fermi wave vector magnitude. Finally, the corresponding enhancement of electron scattering generates a resistivity upturn at decreasing temperatures.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Organic doping of rotated double layer graphene

Charge transfer techniques have been extensively used as knobs to tune electronic properties of two- dimensional systems, such as, for the modulation of conductivity \ mobility of single layer graphene and for opening the bandgap in bilayer graphene. The charge injected into the graphene layer shifts the Fermi level away from the minimum density of states point (Dirac point). In this work, we study charge transfer in rotated double-layer graphene achieved by the use of organic dopant, Tetracyanoquinodimethane. Naturally occurring bilayer graphene has a well-defined A-B stacking whereas in rotated double-layer the two graphene layers are randomly stacked with different rotational angles. This rotation is expected to significantly alter the interlayer interaction. Double-layer samples are prepared using layer-by-layer assembly of chemical vapor deposited single-layer graphene and they are identified by characteristic resonance in the Raman spectrum. The charge transfer and distribution of charges between the two graphene layers is studied using Raman spectroscopy and the results are compared with that for single-layer and A-B stacked bilayer graphene doped under identical conditions.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

FERMI Observations of Gamma -Ray Emission From the Moon

We report on the detection of high-energy γ -ray emission from the Moon during the first 24 months of observations by the Fermi Large Area Telescope (LAT). This emission comes from particle cascades produced by cosmicray (CR) nuclei and electrons interacting with the lunar surface. The differential spectrum of the Moon is soft and can be described as a log-parabolic function with an effective cutoff at 2-3 GeV, while the average integral flux measured with the LAT from the beginning of observations in 2008 August to the end of 2010 August is F(greater than100 MeV) = (1.04 plus or minus 0.01 [statistical error] plus or minus 0.1 [systematic error]) × 10(sup −6) cm(sup −2) s(sup −1). This flux is about a factor 2-3 higher than that observed between 1991 and 1994 by the EGRET experiment on board the Compton Gamma Ray Observatory, F(greater than100 MeV)≈5×10(sup −7) cm(sup −2) s(sup −1), when solar activity was relatively high. The higher gamma -ray flux measured by Fermi is consistent with the deep solar minimum conditions during the first 24 months of the mission, which reduced effects of heliospheric modulation, and thus increased the heliospheric flux of Galactic CRs. A detailed comparison of the light curve with McMurdo Neutron Monitor rates suggests a correlation of the trends. The Moon and the Sun are so far the only known bright emitters of gamma-rays with fast celestial motion. Their paths across the sky are projected onto the Galactic center and high Galactic latitudes as well as onto other areas crowded with high-energy gamma-ray sources. Analysis of the lunar and solar emission may thus be important for studies of weak and transient sources near the ecliptic.

fermi↗

Probing the γ -Ray Emission Origin of Two Star-forming Galaxies NGC 2403 and NGC 3424 with the Fermi-LAT

Star-forming galaxies (SFGs) are a subclass of γ-ray emitters, and a correlation between their γ-ray luminosity (L γ ) and the total infrared (IR) luminosity (L IR ) has been established based on the Fermi Large Area Telescope (LAT) data. NGC 2403 and NGC 3424 have been reported as outliers in the L γ –L IR correlation with light curves showing significant variability, which contrasts with the temporally stable γ-ray emission in other SFGs, originating primarily from cosmic rays interacting with interstellar medium. In this study, we reanalyze the γ-ray emission in the directions of NGC 2403 and NGC 3424 using more than 16.5 yr Fermi-LAT data. NGC 3424 is found to be spatially coincident with the detected γ-ray source, while NGC 2403 is significantly offset from the nearest γ-ray source, suggesting an implausible association. We confirm the previously reported variability of both γ-ray sources and the significant deviation from the L γ –L IR correlation when assuming an association of both γ-ray sources with the two galaxies. Our findings lend further support to the interpretation that their γ-ray emission is driven primarily by alternative radiative processes—rather than by star formation activity—such as the ejecta of the Type IIP supernova SN 2004dj in NGC 2403 interacting with a surrounding high-density shell and an obscured active galactic nucleus in NGC 3424.

Liu, Linjie [Chinese Academy of Sciences (CAS), Ku↗

Carbon nanotunnels form from single-walled carbon nanotubes interacting with a diamond (100)-(2 X 1) surface.

A quantum chemical study of the interaction of (5,5), (7,7), (9,9) and (8,0) single-walled carbon nanotubes with a clean (100)-(2 x 1) diamond surface is reported. Stable structures with covalent bonds at the interface were found for carbon nanotubes oriented parallel or perpendicular to the dimer rows on the reconstructed (100) surface. The binding energy of the most stable (5,5) nanotube-diamond structure is 1.7 eV/{angstrom}, and is attributed to strong covalent bonds formed between the carbon nanotube and the diamond surface. The structure of the nanotube is distorted by adsorption on the surface such that it adopts a tunnel-like geometry. Two other nanotunnel geometries were found for the (5,5) nanotube, with binding energies of 1.39 and 1.09 eV/{angstrom}. In the most stable (5,5) nanotube-diamond structure the interaction between the nanotube and the diamond surface produces a 0.6 eV band gap near the Fermi level, but the metallic character of the nanotube is maintained in the two other, less strongly bound nanotunnel structures. No charge transfer occurs between the diamond surface and the nanotunnels in any of the three orientations. Binding energies decrease with increases in tube diameter, to the extent that one of the three nanotunnel structures is not formed by (9,9) carbon nanotubes.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Tuning electrocatalytic activity of Pt monolayer shell by bimetallic Ir-M (M=Fe, Co, Ni or Cu) cores for the oxygen reduction reaction

Here, platinum monolayer electrocatalyst are known to exhibit excellent oxygen reduction reaction (ORR) activity depending on the type of substrate used. Here we demonstrate a relationship between the ORR electrocatalytic activity and the surface electronic structure of Pt monolayer shell induced by various IrM bimetallic cores (M=Fe, Co, Ni or Cu). The relationship is rationalized by comparing density functional theory calculations and experimental results. For an efficient Pt monolayer electrocatalyst, the core should induce sufficient contraction to the Pt shell leading to a downshift of the d-band center with respect to the Fermi level. Depending on the structure of the IrM, relative to that of pure Ir, this interaction not only alters the electronic and geometric structure but also induces segregation effects. Combined these effects significantly enhance the ORR activities of the Pt monolayer shell on bimetallic Ir cores electrocatalysts.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Magic-angle semimetals

Abstract Breakthroughs in two-dimensional van der Waals heterostructures have revealed that twisting creates a moiré pattern that quenches the kinetic energy of electrons, allowing for exotic many-body states. We show that cold atomic, trapped ion, and metamaterial systems can emulate the effects of a twist in many models from one to three dimensions. Further, we demonstrate at larger angles (and argue at smaller angles) that by considering incommensurate effects, the magic-angle effect becomes a single-particle quantum phase transition (including in a model for twisted bilayer graphene in the chiral limit). We call these models “magic-angle semimetals”. Each contains nodes in the band structure and an incommensurate modulation. At magic-angle criticality, we report a nonanalytic density of states, flat bands, multifractal wave functions that Anderson delocalize in momentum space, and an essentially divergent effective interaction scale. As a particular example, we discuss how to observe this effect in an ultracold Fermi gas.

Materials Science↗

Dichotomy between frustrated local spins and conjugated electrons in a two-dimensional metal–organic framework

Dichotomy between local spins and conjugated electrons spawns various exotic physical phenomena, however, it has mostly been reported in three-dimensional (3D) inorganic systems. We demonstrate, for the first time, that a rare 2D metal–organic framework exhibits intriguing dichotomy behavior, which can be directly identified through scanning tunneling microscopy/spectroscopy (STM/STS). In a newly synthesized Cu-hexaiminobenzene [Cu 3 (HAB) 2 ], on the one hand, the Cu 2+ ions form an ideal S –1/2 antiferromagnetic (AFM) kagome lattice; on the other hand, the conjugated-electrons from the organic ligands produce a frustrated π x , y model on a honeycomb lattice, giving rise to completely dispersionless energy bands around the Fermi level that favour the ferromagnetic (FM) state. Remarkably, the frustrated local spins and conjugated electrons interact through a strong FM Hund's coupling, giving rise to a wide range of intriguing quantum phases. Furthermore, we propose that this dichotomy can be directly characterized through STM/STS measurements due to its special 2D nature, which provides a unique exciting platform to investigate the dichotomy of frustrated spins and electrons in a single lattice.

42 ENGINEERING↗

Analysis of charged-current neutrino-nucleus cross section

A study of the cross section for chaged-current quasielastic (CCQE) scattering on nuclei has been performed using a description of nuclear dynamics based on the Relativistic Fermi Gas model (RFG). The role played by different parametrizations for the weak nucleon form factors is analyzed taking into account the relevance of the axial mass value. The results obtained are compared with the recent data for neutrinos measured by the MiniBooNE Collaboration.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo

We review recent advances in the capabilities of the open source ab initio Quantum Monte Carlo (QMC) package QMCPACK and the workflow tool Nexus used for greater efficiency and reproducibility. The auxiliary field QMC (AFQMC) implementation has been greatly expanded to include k-point symmetries, tensor-hypercontraction, and accelerated graphical processing unit (GPU) support. These scaling and memory reductions greatly increase the number of orbitals that can practically be included in AFQMC calculations, increasing the accuracy. Advances in real space methods include techniques for accurate computation of bandgaps and for systematically improving the nodal surface of ground state wavefunctions. Results of these calculations can be used to validate application of more approximate electronic structure methods, including GW and density functional based techniques. To provide an improved foundation for these calculations, we utilize a new set of correlation-consistent effective core potentials (pseudopotentials) that are more accurate than previous sets; these can also be applied in quantum-chemical and other many-body applications, not only QMC. These advances increase the efficiency, accuracy, and range of properties that can be studied in both molecules and materials with QMC and QMCPACK.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Fermionic quantum processing with programmable neutral atom arrays

Simulating the properties of many-body fermionic systems is an outstanding computational challenge relevant to material science, quantum chemistry, and particle physics.-5.4pc]Please note that the spelling of the following author names in the manuscript differs from the spelling provided in the article metadata: D. González-Cuadra, D. Bluvstein, M. Kalinowski, R. Kaubruegger, N. Maskara, P. Naldesi, T. V. Zache, A. M. Kaufman, M. D. Lukin, H. Pichler, B. Vermersch, Jun Ye, and P. Zoller. The spelling provided in the manuscript has been retained; please confirm. Although qubit-based quantum computers can potentially tackle this problem more efficiently than classical devices, encoding nonlocal fermionic statistics introduces an overhead in the required resources, limiting their applicability on near-term architectures. In this work, we present a fermionic quantum processor, where fermionic models are locally encoded in a fermionic register and simulated in a hardware-efficient manner using fermionic gates. We consider in particular fermionic atoms in programmable tweezer arrays and develop different protocols to implement nonlocal gates, guaranteeing Fermi statistics at the hardware level. We use this gate set, together with Rydberg-mediated interaction gates, to find efficient circuit decompositions for digital and variational quantum simulation algorithms, illustrated here for molecular energy estimation. Finally, we consider a combined fermion-qubit architecture, where both the motional and internal degrees of freedom of the atoms are harnessed to efficiently implement quantum phase estimation as well as to simulate lattice gauge theory dynamics.

74 ATOMIC AND MOLECULAR PHYSICS↗