Search NASA⌕ Search

SEARCH · Search NASA

Results for “SUPERFLUID MODEL”

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.

Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.

At least 235 records · Page 13
All sourcesNASA NTRSDOE OSTI
DOE OSTI2010

Quarkyonic phase in dense two color matter

We present results from simulations of two color QCD with two Wilson quark flavors in the presence of a quark chemical potential {mu} at two different lattice spacings. The equation of state, conformal anomaly, superfluid order parameter, and Polyakov line are all discussed. Our results suggest that the transitions from hadronic to quark matter and from confined to deconfined matter occur at distinct values of {mu}, consistent with the existence of a quarkyonic phase in this model.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2016

Average Atom models

This report discusses average atom models, relatively cheap EOS models based on DFT that can access any temperature or density point for any element.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2011

Low-temperature properties of the infinite-dimensional attractive Hubbard model

We investigate the attractive Hubbard model in infinite spatial dimensions by combining dynamical mean-field theory with a strong-coupling continuous-time quantum Monte Carlo method. By calculating the superfluid order parameter and the density of states, we discuss the stability of the superfluid state. In the intermediate-coupling region above the critical temperature, the density of states exhibits a heavy fermion behavior with a quasiparticle peak in the dense system, while a dip structure appears in the dilute system. The formation of the superfluid gap is also addressed.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2010

Inhomogeneous structures in holographic superfluids. II. Vortices

We study vortex solutions in a holographic model of Herzog, Hartnoll, and Horowitz, with a vanishing external magnetic field on the boundary, as is appropriate for vortices in a superfluid. We study the relevant length scales related to the vortices and how the charge density inside the vortex core behaves as a function of temperature or chemical potential. We extract a critical superfluid velocity from the vortex solutions, study how it behaves as a function of the temperature, and compare it to earlier studies and to the Landau criterion. We also comment on the possibility of a Berezinskii-Kosterlitz-Thouless vortex confinement-deconfinement transition.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2010

Superfluidity and Dimerization in a Multilayered System of Fermionic Polar Molecules

We consider a layered system of fermionic molecules with permanent dipole moments aligned perpendicular to the layers by an external field. The dipole interactions between fermions in adjacent layers are attractive and induce interlayer pairing. Because of the competition for pairing among adjacent layers, the mean-field ground state of the layered system is a dimerized superfluid, with pairing only between every other layer. We construct an effective Ising-XY lattice model that describes the interplay between dimerization and superfluid phase fluctuations. In addition to the dimerized superfluid ground state, and high-temperature normal state, at intermediate temperature, we find an unusual dimerized ''pseudogap'' state with only short-range phase coherence. We propose light-scattering experiments to detect dimerization.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2015

Deformable complex network for refining low-resolution X-ray structures

A new refinement algorithm called the deformable complex network that combines a novel angular network-based restraint with a deformable elastic network model in the target function has been developed to aid in structural refinement in macromolecular X-ray crystallography. In macromolecular X-ray crystallography, building more accurate atomic models based on lower resolution experimental diffraction data remains a great challenge. Previous studies have used a deformable elastic network (DEN) model to aid in low-resolution structural refinement. In this study, the development of a new refinement algorithm called the deformable complex network (DCN) is reported that combines a novel angular network-based restraint with the DEN model in the target function. Testing of DCN on a wide range of low-resolution structures demonstrated that it constantly leads to significantly improved structural models as judged by multiple refinement criteria, thus representing a new effective refinement tool for low-resolution structural determination.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2010

Quantum critical behavior and trap-size scaling of trapped bosons in a one-dimensional optical lattice

We study the quantum (zero-temperature) critical behaviors of confined particle systems described by the one-dimensional (1D) Bose-Hubbard model in the presence of a confining potential, at the Mott insulator to superfluid transitions, and within the gapless superfluid phase. Specifically, we consider the hard-core limit of the model, which allows us to study the effects of the confining potential by exact and very accurate numerical results. We analyze the quantum critical behaviors in the large trap-size limit within the framework of the trap-size scaling (TSS) theory, which introduces a new trap exponent {theta} to describe the dependence on the trap size. This study is relevant for experiments of confined quasi-1D cold atom systems in optical lattices. At the low-density Mott transition, TSS can be shown analytically within the spinless fermion representation of the hard-core limit. The trap-size dependence turns out to be more subtle in the other critical regions, when the corresponding homogeneous system has a nonzero filling f, showing an infinite number of level crossings of the lowest states when increasing the trap size. At the n=1 Mott transition, this gives rise to a modulated TSS: The TSS is still controlled by the trap-size exponent {theta}, but it gets modulated by periodic functions of the trap size. Modulations of the asymptotic power-law behavior is also found in the gapless superfluid region, with additional multiscaling behaviors.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2023

Magnetic and singlet phases in the three-dimensional periodic Anderson Model

Heavy-fermion materials are compounds in which localized f orbitals hybridize with delocalized d ones, leading to quasiparticles with large renormalized masses. The presence of strongly correlated f electrons at the Fermi level may also lead to long-range order, such as magnetism, or unconventional superconductivity. From a theoretical point of view, the “standard model” for heavy-fermion compounds is the periodic Anderson model (PAM). Despite being extensively scrutinized, its thermodynamic properties in three-dimensional (3D) lattices have not been carefully addressed by unbiased methodologies. Here we investigate the 3D PAM employing state-of-the-art finite-temperature auxiliary-field quantum Monte Carlo simulations. Furthermore, we present the behavior of the kinetic energy, the entropy, the specific heat, and the double occupancy as functions of the temperature and the hybridization strength. From these quantities, and by the analysis of the spin-spin correlation functions, we investigate the occurrence of magnetic phase transitions at finite temperatures, and we determine the phase diagram of the model, including the behavior of the Néel temperature as a function of the external parameters.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Nonreciprocal Coulomb drag between quantum wires in the quasi-one-dimensional regime

Coulomb drag experiments have been an essential tool to study strongly interacting low-dimensional systems. Historically, this effect has been explained in terms of momentum transfer between electrons in the active and the passive layer. We report Coulomb drag measurements between laterally coupled GaAs/AlGaAs quantum wires in the multiple one-dimensional (1D) sub-band regime that break Onsager's reciprocity upon both layer and current direction reversal, in contrast to prior 1D Coulomb drag results. The drag signal shows nonlinear current-voltage (I-V) characteristics, which are well characterized by a third-order polynomial fit. These findings are qualitatively consistent with a rectified drag signal induced by charge fluctuations. However, the nonmonotonic temperature dependence of this drag signal suggests that strong electron-electron interactions, expected within the Tomonaga-Luttinger liquid framework, remain important and standard interaction models are insufficient to capture the qualitative nature of rectified 1D Coulomb drag.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Constructing superconductors by graphene Chern–Simons wormholes

We propose a new model which simulates the motion of free electrons in graphene by the evolution of strings on manifolds. In this model, molecules which constitute sheets of graphene are polygonal point-like structures which build (N+1)-dimensional manifolds. By breaking the gravitational-analogue symmetry of graphene sheets, we show that two separated child sheets and a Chern–Simons bridge are produced giving rise to a wormhole. In this structure, free electrons are transmitted from one child sheet to the other producing superconductivity. An analogue between “effective gravitons” and “Cooper pairs” is found. In principle, this phenomenology provides the possibility to construct superconductor structures by using the analogue of cosmological models.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Wave–vortex interactions in the nonlinear Schrödinger equation

This is a theoretical study of wave–vortex interaction effects in the two-dimensional nonlinear Schrödinger equation, which is a useful conceptual model for the limiting dynamics of superfluid quantum condensates at zero temperature. The particular wave–vortex interaction effects are associated with the scattering and refraction of small-scale linear waves by the straining flows induced by quantized point vortices and, crucially, with the concomitant nonlinear back-reaction, the remote recoil, that these scattered waves exert on the vortices. Our detailed model is a narrow, slowly varying wavetrain of small-amplitude waves refracted by one or two vortices. Weak interactions are studied using a suitable perturbation method in which the nonlinear recoil force on the vortex then arises at second order in wave amplitude, and is computed in terms of a Magnus-type force expression for both finite and infinite wavetrains. In the case of an infinite wavetrain, an explicit asymptotic formula for the scattering angle is also derived and cross-checked against numerical ray tracing. Finally, under suitable conditions a wavetrain can be so strongly refracted that it collapses all the way onto a zero-size point vortex. This is a strong wave–vortex interaction by definition. The conditions for such a collapse are derived and the validity of ray tracing theory during the singular collapse is investigated.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Foundations of variational discrete action theory

Variational wave functions and Green's functions are two important paradigms for solving quantum Hamiltonians, each having their own advantages. Here we detail the variational discrete action theory (VDAT), which exploits the advantages of both paradigms in order to approximately solve the ground state of quantum Hamiltonians. VDAT consists of two central components: the sequential product density matrix (SPD) ansatz and a discrete action associated with the SPD. The SPD is a variational ansatz inspired by the Trotter decomposition and characterized by an integer $\mathscr{N}$, recovering many well-known variational wave functions, in addition to the exact solution for $\mathscr{N}$ = ∞. The discrete action describes all dynamical information of an effective integer time evolution with respect to the SPD. We generalize the path integral to our integer time formalism, which converts a dynamic correlation function in integer time to a static correlation function in a compound space. We also generalize the usual many-body Green's function formalism to integer time, which results in analogous but distinct mathematical structures, yielding integer time versions of the generating functional, Dyson equation, and Bethe-Salpeter equation. We prove that the SPD can be exactly evaluated in the multiband Anderson impurity model (AIM) by summing a finite number of diagrams. For the multiband Hubbard model, we prove that the self-consistent canonical discrete action approximation (SCDA), which is the integer time analog of the dynamical mean-field theory, exactly evaluates the SPD for d = ∞. VDAT within the SCDA provides an efficient yet reliable method for capturing the local physics of quantum lattice models, which will have broad applications for strongly correlated electron materials. More generally, VDAT should find applications in various many-body problems in physics.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Two-dimensional models for the optical response of thin films

Here, we present a systematic study of 2D optical models for the response of thin layers of material under excitation by normally incident light. The treatment, within the framework of classical optics, analyzes a thin film supported by a semi-infinite substrate, with both the thin layer and the substrate assumed to exhibit local, isotropic linear response. Starting from the conventional three-dimensional (3D) slab model of the system, we derive a two-dimensional (2D) sheet model for the thin film in which the optical response is described by a sheet optical conductivity. We develop criteria for the applicability of this 2D sheet model for a layer with an optical thickness far smaller than the wavelength of the light. We examine in detail atomically thin semi-metallic and semiconductor van-der-Waals layers and ultrathin metal films as representative examples. Excellent agreement of the 2D sheet model with the 3D slab model is demonstrated over a broad spectral range from the radio frequency limit to the near ultraviolet. A linearized version of system response for the 2D model is also presented for the case where the influence of the optically thin layer is sufficiently weak. Analytical expressions for the applicability and accuracy of the different optical models are derived, and the appropriateness of the linearized treatment for the materials is considered. We discuss the advantages, as well as limitations, of these models for the purpose of deducing the optical response function of the thin layer from experiment. We generalize the theory to take into account in-plane anisotropy, layered thin film structures, and more general substrates. Implications of the 2D model for the transmission of light by the thin film and for the implementation of half- and totally absorbing layers are discussed.

2D materials↗
DOE OSTI2010

Benchmarking the variational cluster approach by means of the one-dimensional Bose-Hubbard model

Convergence properties of the variational cluster approach with respect to the variational parameter space, cluster size, and boundary conditions of the reference system are investigated and discussed for bosonic many-body systems. Specifically, the variational cluster approach is applied to the one-dimensional Bose-Hubbard model, which exhibits a quantum phase transition from Mott to superfluid phase. In order to benchmark the variational cluster approach, results for the phase boundary delimiting the first Mott lobe are compared with essentially exact density matrix renormalization group data. Furthermore, static quantities, such as the ground state energy and the one-particle density matrix are compared with high-order strong coupling perturbation theory results. For reference systems with open boundary conditions the variational parameter space is extended by an additional variational parameter which allows for a more uniform particle density on the reference system and thus drastically improves the results. It turns out that the variational cluster approach yields accurate results with relatively low-computational effort for both the phase boundary as well as the static properties of the one-dimensional Bose-Hubbard model, even at the tip of the first Mott lobe where correlation effects are most pronounced.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2023

Competing magnetic fluctuations and orders in a multiorbital model of doped SrCo 2 ⁢As 2

We revisit the intriguing magnetic behavior of the paradigmatic itinerant frustrated magnet Sr⁢Co 2 ⁢As 2 , which shows strong and competing magnetic fluctuations yet does not develop long-range magnetic order. By calculating the static spin susceptibility Χ⁡(q) within a realistic 16-orbital Hubbard-Hund model, we determine the leading instability to be ferromagnetic (FM). We then explore the effect of doping and calculate the critical Hubbard interaction strength U c that is required for the development of magnetic order. We find that U c decreases under electron doping and with increasing Hund's coupling J, but increases rapidly under hole doping. This suggests that magnetic order could possibly emerge under electron doping but not under hole doping, which agrees with experimental findings. We map out the leading magnetic instability as a function of doping and Hund's coupling and find several antiferromagnetic phases in addition to FM. We also quantify the degree of itinerant frustration in the model and resolve the contributions of different orbitals to the magnetic susceptibility. Lastly, we discuss the dynamic spin susceptibility Χ⁡(q,ω) at finite frequencies, where we recover the anisotropy of the peaks at Q π = (π,0) and (0,π) observed by inelastic neutron scattering that is associated with the phenomenon of itinerant magnetic frustration. By comparing results between theory and experiment, we conclude that the essential experimental features of doped SrCo 2 ⁢As 2 are well captured by an itinerant Hubbard-Hund multiorbital model if one considers a small shift of the chemical potential towards hole doping.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2011

ANGULAR MOMENTUM TRANSFER IN VELA-LIKE PULSAR GLITCHES

The angular momentum transfer associated with Vela-like glitches has never been calculated directly within a realistic scenario for the storage and release of superfluid vorticity; therefore, the explanation of giant glitches in terms of vortices has not yet been tested against observations. We present the first physically reasonable model, both at the microscopic and macroscopic level (spherical geometry, n = 1 polytropic density profile, density-dependent pinning forces compatible with vortex rigidity), to determine where in the star the vorticity is pinned, how much of it is pinned, and for how long. For standard neutron star parameters (M = 1.4 M{sub Sun }, R{sub s} = 10 km, {Omega}-dot = {Omega}-dot{sub Vela} = -10{sup -10} Hz s{sup -1}), we find that maximum pinning forces of order f{sub m} Almost-Equal-To 10{sup 15} dyn cm{sup -1} can accumulate {Delta}L{sub gl} Almost-Equal-To 10{sup 40} erg s of superfluid angular momentum, and release it to the crust at intervals {Delta}t{sub gl} Almost-Equal-To 3 years. This estimate of {Delta}L{sub gl} is one order of magnitude smaller than that implied indirectly by current models for post-glitch recovery, where the core and inner-crust vortices are taken as physically disconnected; yet, it successfully yields the magnitudes observed in recent Vela glitches for both jump parameters, {Delta}{Omega}{sub gl} and {Delta}{Omega}-dot{sub gl}, provided one assumes that only a small fraction (<10%) of the total star vorticity is coupled to the crust on the short timescale of a glitch. This is reasonable in our approach, where no layer of normal matter exists between the core and the inner-crust, as indicated by existing microscopic calculation. The new scenario presented here is nonetheless compatible with current post-glitch models.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

Magnetic multilayer edges in Bernal-stacked hexagonal boron nitride

Single-layer h-BN is known to have edges with unique magnetism; however, in the commonly fabricated multilayer AA'-h-BN, edge relaxations occur that create interlayer bonds and eliminate the unpaired electrons at the edge. Recently, a robust method of growing the unconventional Bernal-stacked h-BN (AB-h-BN) has been reported. Here, we use theoretical approaches to investigate the nitrogen-terminated zigzag edges in AB-h-BN that can be formed in a controlled fashion using a high-energy electron beam. We find that these "open"edges remain intact in bilayer and multilayer AB-h-BN, enabling researchers potentially to investigate these edge states experimentally. We also investigate the thermodynamics of the spin configurations at the edge by constructing a lattice model that is based on parameters extracted from a set of first-principles calculations. We find that the edge spins in neighboring layers interact very weakly, resulting in a sequence of independent spin chains in multilayer samples. By solving this model using Monte Carlo simulations, we can determine nm-scale correlation lengths at liquid-N 2 temperatures and lower. At low temperatures, these edges may be utilized in magnetoresistance and spintronics applications.

1-dimensional spin chains↗
DOE OSTI2025

Particle-hole asymmetric phases in doped twisted bilayer graphene

Twisted bilayer graphene (TBG) has emerged as a paradigmatic platform for exploring the interplay between strong interactions in a multi-band system with nearly flat bands, while offering unprecedented control over the filling fraction of electron/hole carriers. Despite much theoretical work, developing a comprehensive ab initio model for this system has proven challenging due to the inherent trade-off between accurately describing the band structure and incorporating the interactions within the Hamiltonian. Here, we constructed an extended multi-orbital Hubbard model, and performed Hartree-Fock (HF) calculations to explore its phase diagram across commensurate fillings. We found several nearly-degenerate insulating states at charge neutrality, all of which exhibit orbital orders. We also observed that most of the Hartree–Fock ground states exhibit a generalized valley Hund’s-like rule, resulting in valley polarization. Importantly, we show that the incorporation of the intra-valley and inter-valley exchange interactions is crucial to properly stabilize the ordered symmetry-broken states. In agreement with experiments, we find significant particle-hole asymmetry, which underscores the importance of using particle-hole asymmetric models.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗