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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 469 records · Page 26
All sourcesNASA NTRSDOE OSTI
DOE OSTI2014

Electronic properties of graphite in tilted magnetic fields

The minimal nearest-neighbor tight-binding model with the Peierls substitution is employed to describe the electronic structure of Bernal-stacked graphite subject to tilted magnetic fields. We show that while the presence of the in-plane component of the magnetic field has a negligible effect on the Landau level structure at the K point of the graphite Brillouin zone, at the H point it leads to the experimentally observable splitting of Landau levels which grows approximately linearly with the in-plane field intensity.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Nonequilibrium Dynamical Mean-Field Theory for the Charge-Density-Wave Phase of the Falicov-Kimball Model

Nonequilibrium dynamical mean-field theory (DMFT) is developed for the case of the charge-density-wave ordered phase. We consider the spinless Falicov-Kimball model which can be solved exactly. This strongly correlated system is then placed in an uniform external dc electric field. We present a complete derivation for nonequilibrium dynamical mean-field theory Green’s functions defined on the Keldysh-Schwinger time contour. Here, we also discuss numerical issues involved in solving the coupled equations.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2010

Quantum dynamics of attractive versus repulsive bosonic Josephson junctions: Bose-Hubbard and full-Hamiltonian results

The quantum dynamics of one-dimensional bosonic Josephson junctions with attractive and repulsive interparticle interactions is studied by using the Bose-Hubbard model and by numerically exact computations of the full many-body Hamiltonian. A symmetry present in the Bose-Hubbard Hamiltonian dictates an equivalence between the evolution in time of the survival probability and the fragmentation of attractive and repulsive Josephson junctions with attractive and repulsive interactions of equal magnitude. The full many-body Hamiltonian does not possess this symmetry and, consequently, the dynamics of the attractive and repulsive junctions are different.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2024

Single-shot quantum error correction in intertwined toric codes

We construct a subsystem code in three dimensions that exhibits single-shot error correction in a user-friendly and transparent way. As this code is a subsystem version of coupled toric codes, we call it the intertwined toric code (ITC). Although previous codes share the property of single-shot error correction, the ITC is distinguished by its physically motivated origin, geometrically straightforward logical operators and errors, and a simple phase diagram. The code arises from three-dimensional (3D) stabilizer toric codes in a way that emphasizes the physical origin of the single-shot property. In particular, starting with two copies of the 3D toric code, we add check operators that provide for the confinement of pointlike excitations without condensing the loop excitations. Geometrically, the bare and dressed logical operators in the ITC derive from logical operators in the underlying toric codes, creating a clear relationship between errors and measurement outcomes. The syndromes of the ITC resemble the syndromes of the single-shot code by Kubica and Vasmer, allowing us to use their decoding schemes. We also extract the phase diagram corresponding to ITC and show that it contains the phases found in the Kubica-Vasmer code. Lastly, we suggest various connections to Walker-Wang models and measurement-based quantum computation.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2010

Quantum Quenches and Off-Equilibrium Dynamical Transition in the Infinite-Dimensional Bose-Hubbard Model

We study the off-equilibrium dynamics of the infinite-dimensional Bose-Hubbard model after a quantum quench. The dynamics can be analyzed exactly by mapping it to an effective Newtonian evolution. For integer filling, we find a dynamical transition separating regimes of small and large quantum quenches starting from the superfluid state. This transition is very similar to the one found for the fermionic Hubbard model by mean field approximations.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2019

Langevin simulations of a long-range electron-phonon model

We present a quantum Monte Carlo (QMC) study, based on the Langevin equation, of a Hamiltonian describing electrons coupled to phonon degrees of freedom. The bosonic part of the action helps control the variation of the field in imaginary time. As a consequence, the iterative conjugate gradient solution of the fermionic action, which depends on the boson coordinates, converges more rapidly than in the case of electron-electron interactions, such as the Hubbard Hamiltonian. Fourier acceleration is shown to be a crucial ingredient in reducing the equilibration and autocorrelation times. After describing and benchmarking the method, we present results for the phase diagram focusing on the range of the electron-phonon interaction. Furthermore, we delineate the regions of charge density wave formation from those in which the fermion density is inhomogeneous, caused by phase separation. We show that the Langevin approach is more efficient than the determinant QMC method for lattice sizes N ≳ 8 × 8 and that it therefore opens a potential path to problems including, for example, charge order in the three-dimensional Holstein model.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2023

Superfluid dark matter around black holes

Superfluid dark matter, consisting of self-interacting light particles that thermalize and condense to form a superfluid in galaxies, provides a novel theory that matches the success of the standard ΛCDM model on cosmological scales while simultaneously offering a rich phenomenology on galactic scales. Within galaxies, the dark matter density profile consists of a nearly homogeneous superfluid core surrounded by an isothermal envelope. In this work we compute the density profile of superfluid dark matter around supermassive black holes at the center of galaxies. Here, in this work, we show that, depending on the fluid equation of state, the dark matter profile presents distinct power-law behaviors, which can be used to distinguish it from the standard results for collisionless dark matter.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2019

Charge Order of Strongly Bounded Electron Pairs on the Triangular Lattice: the Zero-Bandwidth Limit of the Extended Hubbard Model with Strong Onsite Attraction

The inhomogeneous distribution of charged particles is known as charge-order phenomena. Recent experimental studies of (quasi-) two-dimensional materials found different ordered patterns on the triangular lattice. In this work, the preliminary studies of the extended Hubbard model (with the intersite Coulomb density-density repulsion) in the atomic limit on the triangular lattice are presented. The model is investigated within the mean-field approach that treats the onsite term exactly. The finite temperature phase diagrams including metastable phases and some characteristics of the model are determined for the limit of strong onsite attraction. It is shown that in the limit considered all transitions between stable phases are discontinuous (for fixed chemical potential), which is totally different from the model on the alternate lattices. Continuous transitions between metastable phases are also found.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2011

Solid phases and pairing in a mixture of polar molecules and atoms

We consider a mixture of hard-core bosonic polar molecules, interacting via repulsive dipole-dipole interaction, and one atomic bosonic species. The mixture is confined on a two-dimensional square lattice and, at low enough temperatures, can be described by the two-component Bose-Hubbard model. The latter displays an extremely rich phase diagram including solid, superfluid, and supersolid phases. Here, we mainly focus on the checkerboard molecular solid, stabilized by the long-range dipolar interaction, and study how the presence of atoms affects its robustness both at zero and finite temperatures. We find that, due to atom-molecule interactions, solid phases can be stabilized at both (much) lower strengths of dipolar interaction and higher temperatures, than when no atoms are present. As a byproduct, atoms also order in a solid phase with the same melting temperatures as for molecules. Finally, we find that for large enough interaction between atoms and molecules, a paired supersolid phase can be stabilized.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2010

Dynamic Phase Transitions In The Spin-2 Ising System Under An Oscillating Magnetic Field Within The Effective-Field Theory

The dynamic phase transitions are studied in the spin-2 Ising model under a time-dependent oscillating magnetic field by using the effective-field theory with correlations. The effective-field dynamic equation is derived by employing the Glauber transition rates and the phases in the system are obtained by solving this dynamic equation. The nature (first- or second-order) of the dynamic phase transition is characterized by investigating the thermal behavior of the dynamic order parameter and the dynamic phase transition temperatures are obtained. The dynamic phase diagrams are presented in (T/zJ, h/zJ) plane.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2014

Critical behavior of the ferromagnetic-paramagnetic phase transition in Fe{sub 90−x}Ni{sub x}Zr{sub 10} alloy ribbons

This work presents a detailed study on the critical behavior of the ferromagnetic-paramagnetic (FM-PM) phase transition in Fe{sub 90−x}Ni{sub x}Zr{sub 10} (x = 0 and 5) alloy ribbons. Basing on field dependences of magnetization (M-H), M{sup 2} versus H/M plots prove the alloys exhibiting a second-order magnetic phase transition. To investigate the nature of the FM-PM phase transition at T{sub C} = 245 and 306 K for x = 0 and 5, respectively, we performed a critical-exponent study. The values of critical components β, γ, and δ determined by using the modified Arrott plots, Kouvel-Fisher (KF), and critical isotherm analyses agree with each other. For x = 0, the critical parameters β = 0.365 ± 0.013 and γ = 1.615 ± 0.033 are obtained by modified Arrott plots while β = 0.368 ± 0.008 and γ = 1.612 ± 0.016 are obtained by the KF method. These values are close to those expected for the 3D-Heisenberg model, revealing short-range FM interactions in Fe{sub 90}Zr{sub 10}. Meanwhile, for x = 5, the values of the critical parameters β = 0.423 ± 0.008 and γ = 1.325 ± 0.036 are obtained by modified Arrott plots, and β = 0.425 ± 0.006 and γ = 1.323 ± 0.012 are obtained by the KF method. The falling of the β value in between the values of the mean-field theory (β = 0.5) and the 3D-Heisenberg model (β = 0.365) indicates an existence of FM short-range order and magnetic inhomogeneity in Fe{sub 85}Ni{sub 5}Zr{sub 10}. With a partial replacement of Ni for Fe in Fe{sub 90−x}Ni{sub x}Zr{sub 10}, the value of the critical exponent β trends to shift towards that of the mean-field theory. Such the result proves the presence of Ni favors establishing FM long-range order. The nature of this phenomenon is carefully discussed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2011

Collapse and revival dynamics of number-squeezed superfluids of ultracold atoms in optical lattices

Recent experiments have shown a remarkable number of collapse and revival oscillations of the matter-wave coherence of ultracold atoms in optical lattices [Will et al., Nature (London) 465, 197 (2010)]. Using a mean-field approximation to the Bose-Hubbard model, we show that the visibility of collapse and revival interference patterns reveals number squeezing of the initial superfluid state. To describe the dynamics, we use an effective Hamiltonian that incorporates the intrinsic two-body and induced three-body interactions, and we analyze in detail the resulting complex pattern of collapse and revival frequencies generated by virtual transitions to higher bands, as a function of lattice parameters and mean-atom number. Our work shows that a combined analysis of both the multiband, nonstationary dynamics in the final deep lattice and the number squeezing of the initial superfluid state explains important characteristics of optical lattice collapse and revival physics. Finally, by treating the two- and three-body interaction strengths and the coefficients describing the initial superposition of number states as free parameters in a fit to the experimental data, it should be possible to go beyond some of the limitations of our model and obtain insight into the breakdown of the mean-field theory for the initial state or the role of nonperturbative effects in the final-state dynamics.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2019

Single-layer tensor network study of the Heisenberg model with chiral interactions on a kagome lattice

Here, we study the antiferromagnetic kagome Heisenberg model with an additional scalar-chiral interaction by using the infinite projected entangled-pair state (iPEPS) ansatz. We discuss in detail the implementation of the optimization algorithm in the framework of the single-layer tensor network based on the corner transfer matrix technique. Our benchmark based on the full-update algorithm shows that the single-layer algorithm is stable, which leads to the same level of accuracy as the double-layer ansatz but with much less computation time. We further apply this algorithm to study the nature of the kagome Heisenberg model with a scalar-chiral interaction by computing the bond dimension scaling of magnetization, bond energy difference, chiral order parameter, and correlation length. In particular, we find that for strong chiral coupling the correlation length, which is extracted from the transfer matrix, saturates to a finite value for large bond dimension, representing a gapped spin-liquid state. Further comparison with density matrix renormalization group results supports that our iPEPS faithfully represents the time-reversal symmetry breaking chiral state. Our iPEPS simulation results shed new light on constructing PEPS for describing gapped chiral topological states.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2011

Application of a multisite mean-field theory to the disordered Bose-Hubbard model

We present a multisite formulation of mean-field theory applied to the disordered Bose-Hubbard model. In this approach the lattice is partitioned into clusters, each isolated cluster being treated exactly, with intercluster hopping being treated approximately. The theory allows for the possibility of a different superfluid order parameter at every site in the lattice, such as what has been used in previously published site-decoupled mean-field theories, but a multisite formulation also allows for the inclusion of spatial correlations allowing us, e.g., to calculate the correlation length (over the length scale of each cluster). We present our numerical results for a two-dimensional system. This theory is shown to produce a phase diagram in which the stability of the Mott-insulator phase is larger than that predicted by site-decoupled single-site mean-field theory. Two different methods are given for the identification of the Bose-glass-to-superfluid transition, one an approximation based on the behavior of the condensate fraction, and one that relies on obtaining the spatial variation of the order parameter correlation. The relation of our results to a recent proposal that both transitions are non-self-averaging is discussed.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2011

Orbital order of spinless fermions near an optical Feshbach resonance

We study the quantum phases of a three-color Hubbard model that arises in the dynamics of the p-band orbitals of spinless fermions in an optical lattice. Strong, color-dependent interactions are induced by an optical Feshbach resonance. Starting from the microscopic scattering properties of ultracold atoms, we derive the orbital exchange constants at 1/3 filling on the cubic optical lattice. Using this, we compute the phase diagram in a Gutzwiller ansatz. We find phases with ''axial orbital order'' in which p{sub z} and p{sub x}+ip{sub y} (or p{sub x}-ip{sub y}) orbitals alternate.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2021

Evidence against the wobbling nature of low-spin bands in 135 Pr

The electromagnetic character of the ΔI=1 transitions connecting the 1- to 0-phonon and the 2- to 1-phonon wobbling bands should be dominated by an E2 component, due to the collective motion of the entire nuclear charge. In the present work it is shown, based on combined angular correlation and linear polarization measurements, that the mixing ratios of all analyzed connecting transitions between low-lying bands in 135 Pr interpreted as 0-, 1-, and 2-phonon wobbling bands, have absolute values smaller than one. This indicates predominant M1 magnetic character, which is incompatible with the proposed wobbling nature. All experimental observables are instead in good agreement with quasiparticle-plus-triaxial-rotor model calculations, which describe the bands as resulting from a rapid re-alignment of the total angular momentum from the short to the intermediate nuclear axis

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Fluctuations analysis of spin susceptibility: Néel ordering revisited in dynamical mean field theory

Here in this paper, we revisit the antiferromagnetic (AF) phase diagram of the single-band three-dimensional half-filled Hubbard model on a simple cubic lattice studied within the dynamical mean field theory (DMFT). Although this problem has been investigated extensively in the literature, a comprehensive understanding of the impact of the different one- and, in particular, two-particle local correlation functions of DMFT on the AF transition temperature is still missing. We have, hence, performed a fluctuation analysis of T N with respect to different local bosonic fluctuations (charge, spin, particle-particle) contained in the two-particle vertex of DMFT. Our results indicate that, beyond weak coupling, the screening of the DMFT vertex by local fluctuations leads to an enhancement of T N with respect to a random phase approximation (RPA) like calculation where this vertex is replaced by the bare interaction. The overall suppression of T N in DMFT with respect to RPA is then solely due to the incoherence introduced by the DMFT self-energy in the one-particle Green's functions. This illustrates the Janus-faced role of the local moment formation in the DMFT solution of the Hubbard model, which leads to completely opposite effects in the one- and two-particle correlation functions.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Spin-orbit enabled quantum transport channels in a two-hole double quantum dot

We analyze experimentally and theoretically the transport spectra of a gated lateral GaAs double quantum dot containing two holes. The strong spin-orbit interaction present in the hole subband lifts the Pauli spin blockade and allows to map out the complete spectra of the two-hole system. By performing measurements in both source-drain voltage directions, at different detunings and magnetic fields, we carry out quantitative fitting to a Hubbard two-site model accounting for the tunnel coupling to the leads and the spin-flip relaxation process. We extract the singlet-triplet gap and the magnetic field corresponding to the singlet-triplet transition in the double-hole ground state. Additionally, at the singlet-triplet transition we find a resonant enhancement (in the blockaded direction) and suppression of current (in the conduction direction). The current enhancement stems from the multiple resonance of two-hole levels, opening several conduction channels at once. The current suppression arises from the quantum interference of spin-conserving and spin-flipping tunneling processes.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗