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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 325 records · Page 18
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Mapping out the thermodynamic stability of a QCD equation of state with a critical point using active learning

The Beam Energy Scan Theory (BEST) collaboration's equation of state (EoS) incorporates a three-dimensional Ising model critical point into the quantum chromodynamics (QCD) equation of state from lattice simulations. Furthermore, it contains four free parameters related to the size and location of the critical region in the QCD phase diagram. Certain combinations of the free parameters lead to acausal or unstable realizations of the EoS that should not be considered. In this work, we use an active learning framework to rule out pathological EoS efficiently. We find that checking stability and causality for a small portion of the parameters' range is sufficient to construct algorithms that perform with > 96 % accuracy across the entire parameter space. Though in this work we focus on a specific case, our approach can be generalized to any EoS containing a parameter space-class correspondence.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2017

Cumulants and correlation functions versus the QCD phase diagram

Here, we discuss the relation of particle number cumulants and correlation functions. It is argued that measuring couplings of the genuine multiparticle correlation functions could provide cleaner information on possible nontrivial dynamics in heavy-ion collisions. We also extract integrated multiproton correlation functions from the presently available experimental data on proton cumulants. We find that the STAR data contain significant four-proton correlations, at least at the lower energies, with indication of changing dynamics in central collisions. We also find that these correlations are rather long ranged in rapidity. Finally, using the Ising model, we demonstrate how the signs of the multiproton correlation functions may be used to exclude certain regions of the phase diagram close to the critical point.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Improved algorithm for dynamical triangulations and simulations of finer lattices

We introduce a new algorithm for the simulation of Euclidean dynamical triangulations that mimics the Metropolis-Hastings algorithm, but where all proposed moves are accepted. This rejection-free algorithm allows for the factorization of local and global terms in the action, a condition needed for efficient simulation of theories with global terms, while still maintaining detailed balance. We test our algorithm on the 2 d Ising model, and against results for EDT obtained with standard Metropolis. Our new algorithm allows us to simulate EDT at finer lattice spacings than previously possible, and we find geometries that resemble semiclassical Euclidean de Sitter space in agreement with earlier results at coarser lattices. The agreement between lattice data and the classical de Sitter solution continues to get better as the lattice spacing decreases. Published by the American Physical Society 2024

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Finite density QCD equation of state: Critical point and lattice-based 𝑇′ expansion

Here, we present a novel construction of the QCD equation of state (EoS) at finite baryon density. Our work combines a recently proposed resummation scheme for lattice QCD results with the universal critical behavior at the QCD critical point. This allows us to obtain a family of equations of state in the range 0 ≤ 𝜇 𝐵 ≤ 700 MeV and 25 MeV ≤ 𝑇 ≤ 800 MeV, which match lattice QCD results near 𝜇 𝐵 =0 while featuring a critical point in the 3D Ising model universality class. The position of the critical point can be chosen within the range accessible to beam-energy scan heavy-ion collision experiments. The strength of the singularity and the shape of the critical region are parametrized using a standard parameter set. We impose stability and causality constraints and discuss the available ranges of critical point parameter choices, finding that they extend beyond earlier parametric QCD EoS proposals. We present thermodynamic observables, including baryon density, pressure, entropy density, energy density, baryon susceptibility and speed of sound, that cover a wide range in the QCD phase diagram relevant for experimental exploration.

Astronomy & Astrophysics↗
DOE OSTI2024

Entanglement entropy of (2 +1)-dimensional SU(2) lattice gauge theory on plaquette chains

We study the entanglement entropy of Hamiltonian SU(2) lattice gauge theory in 2 +1 dimensions on linear plaquette chains and show that the entanglement entropies of both ground and excited states follow Page curves. The transition of the subsystem size dependence of the entanglement entropy from the area law for the ground state to the volume law for highly excited states is found to be described by a universal crossover function. Quantum many-body scars in the middle of the spectrum, which are present in the electric flux truncated Hilbert space, where the gauge theory can be mapped onto an Ising model, disappear when higher electric field representations are included in the Hilbert space basis. This suggests the continuum (2+1)-dimensional SU(2) gauge theory does not have such scarred states.

Astronomy & Astrophysics↗
DOE OSTI2025

Quantum real-time evolution using tensor renormalization group methods

We introduce an approach for approximate real-time evolution of quantum systems using tensor renormalization group (TRG) methods originally developed for imaginary time. We use higher-order TRG to generate a coarse-grained time evolution operator for a 1+1⁢D transverse Ising model with a longitudinal field. We show that the standard tensor norm used for the singular value decomposition-based truncation is degenerate and propose an alternate method to discriminate. We show that it is effective and efficient in evolving Gaussian wave packets for one and two particles in the disordered phase, while ordered phase behavior is more challenging to capture. We compare our algorithm with local simulators for universal quantum computers and discuss possible benchmarking in the near future.

lattice gauge theory↗
DOE OSTI2019

Diffusive dynamics of critical fluctuations near the QCD critical point

A quantitatively reliable theoretical description of the dynamics of fluctuations in nonequilibrium is indispensable in the experimental search for the QCD critical point by means of ultrarelativistic heavy-ion collisions. Herein we consider the fluctuations of the net-baryon density which becomes the slow, critical mode near the critical point. Due to net-baryon number conservation the dynamics is described by the fluid dynamical diffusion equation, which we extend to contain a white noise stochastic current. Including nonlinear couplings from the 3d Ising model universality class in the free energy functional, we solve the fully interacting theory in a finite size system. We observe that purely Gaussian white noise generates non-Gaussian fluctuations, but finite size effects and exact net-baryon number conservation lead to significant deviations from the expected behavior in equilibrated systems. In particular the skewness shows a qualitative deviation from infinite volume expectations.With this benchmark established we study the real-time dynamics of the fluctuations. We recover the expected dynamical scaling behavior and observe retardation effects and the impact of critical slowing down near the pseudocritical temperature.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2022

Dynamical tuning of the chemical potential to achieve a target particle number in grand canonical Monte Carlo simulations

We present a method to facilitate Monte Carlo simulations in the grand canonical ensemble given a target mean particle number. The method imposes a fictitious dynamics on the chemical potential, to be run concurrently with the Monte Carlo sampling of the physical system. Corrections to the chemical potential are made according to time-averaged estimates of the mean and variance of the particle number, with the latter being proportional to thermodynamic compressibility. Here, we perform a variety of tests, and in all cases find rapid convergence of the chemical potential—inexactness of the tuning algorithm contributes only a minor part of the total measurement error for realistic simulations.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2023

Group-equivariant autoencoder for identifying spontaneously broken symmetries

We introduce the group-equivariant autoencoder (GE autoencoder), a deep neural network (DNN) method that locates phase boundaries by determining which symmetries of the Hamiltonian have spontaneously broken at each temperature. We use group theory to deduce which symmetries of the system remain intact in all phases, and then use this information to constrain the parameters of the GE autoencoder such that the encoder learns an order parameter invariant to these “never-broken” symmetries. This procedure produces a dramatic reduction in the number of free parameters such that the GE-autoencoder size is independent of the system size. We include symmetry regularization terms in the loss function of the GE autoencoder so that the learned order parameter is also equivariant to the remaining symmetries of the system. By examining the group representation by which the learned order parameter transforms, we are then able to extract information about the associated spontaneous symmetry breaking. We test the GE autoencoder on the 2D classical ferromagnetic and antiferromagnetic Ising models, finding that the GE autoencoder (1) accurately determines which symmetries have spontaneously broken at each temperature; (2) estimates the critical temperature in the thermodynamic limit with greater accuracy, robustness, and time efficiency than a symmetry-agnostic baseline autoencoder; and (3) detects the presence of an external symmetry-breaking magnetic field with greater sensitivity than the baseline method. Lastly, we describe various key implementation details, including a quadratic-programming-based method for extracting the critical temperature estimate from trained autoencoders and calculations of the DNN initialization and learning rate settings required for fair model comparisons.

42 ENGINEERING↗
DOE OSTI2018

Examples of renormalization group transformations for image sets

Using the example of configurations generated with the worm algorithm for the two-dimensional Ising model, we propose renormalization group (RG) transformations, inspired by the tensor RG, that can be applied to sets of images. We relate criticality to the logarithmic divergence of the largest principal component. We discuss the changes in link occupation under the RG transformation, suggest ways to obtain data collapse, and compare with the two-state tensor RG approximation near the fixed point.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Indications for a Critical End Point in the Phase Diagram for Hot and Dense Nuclear Matter

Here, excitation functions for the Gaussian emission source radii difference ( R out 2 - R side 2 ) obtained from two-pion interferometry measurements in Au + Au ( s N N = 7.7 – 200 GeV ) and Pb + Pb ( s N N = 2.76 TeV ) collisions are reported on for a broad range of collision centralities. The observed nonmonotonic excitation functions validate the finite-size scaling patterns expected for the deconfinement phase transition and the critical end point (CEP), in the temperature versus baryon chemical potential ( T , μ B ) plane of the nuclear matter phase diagram. A finite-size scaling (FSS) analysis of these data suggests a second order phase transition with the estimates T cep ~ 165 MeV and μ B cep ~ 95 MeV for the location of the critical end point. The critical exponents ( ν ≈ 0.66 and γ ≈ 1.2 ) extracted via the same FSS analysis place this CEP in the 3D Ising model universality class.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2016

Universal Off-Equilibrium Scaling of Critical Cumulants in the QCD Phase Diagram

Exploiting the universality between the QCD critical point and the three-dimensional Ising model, closed form expressions derived for nonequilibrium critical cumulants on the crossover side of the critical point reveal that they can differ in both magnitude and sign from equilibrium expectations. Here, we demonstrate here that key elements of the Kibble-Zurek framework of nonequilibrium phase transitions can be employed to describe the dynamics of these critical cumulants. Lastly, our results suggest that observables sensitive to critical dynamics in heavy-ion collisions should be expressible as universal scaling functions, thereby providing powerful model-independent guidance in searches for the QCD critical point.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2017

Variational Approach to Monte Carlo Renormalization Group

We present a Monte Carlo method for computing the renormalized coupling constants and the critical exponents within renormalization theory. The scheme, which derives from a variational principle, overcomes critical slowing down, by means of a bias potential that renders the coarse grained variables uncorrelated. Here, the two-dimensional Ising model is used to illustrate the method.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Fast Rotational Diffusion of Water Molecules in a 2D Hydrogen Bond Network at Cryogenic Temperatures

Individual water molecules or small clusters of water molecules contained within microporous minerals present an extreme case of confinement where the local structure of hydrogen bond networks are dramatically altered from bulk water. In the zinc silicate hemimorphite, the water molecules form a two-dimensional hydrogen bond network with hydroxyl groups in the crystal framework. Here in this paper, we present a combined experimental and theoretical study of the structure and dynamics of water molecules within this network. The water molecules undergo a continuous phase transition in their orientational configuration analogous to a two-dimensional Ising model. The incoherent dynamic structure factor reveals two thermally activated relaxation processes, one on a subpicosecond timescale and another on a 10–100 ps timescale, between 70 and 130 K. The slow process is an in-plane reorientation of the water molecule involving the breaking of hydrogen bonds with a framework that, despite the low temperatures involved, is analogous to rotational diffusion of water molecules in the bulk liquid. The fast process is a localized motion of the water molecule with no apparent analogs among known bulk or confined phases of water.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Simulation of Nonequilibrium Dynamics on a Quantum Computer

We present a hybrid quantum-classical algorithm for the time evolution of out-of-equilibrium thermal states. Here, the method depends on classically computing a sparse approximation to the density matrix and, then, time-evolving each matrix element via the quantum computer. For this exploratory study, we investigate a time-dependent Ising model with five spins on the Rigetti Forest quantum virtual machine and a one spin system on the Rigetti 8Q-Agave quantum processor.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Universal Statistics of Topological Defects Formed in a Quantum Phase Transition

We report when a quantum phase transition is crossed in finite time, critical slowing down leads to the breakdown of adiabatic dynamics and the formation of topological defects. The average density of defects scales with the quench rate following a universal power law predicted by the Kibble-Zurek mechanism. We analyze the full counting statistics of kinks and report the exact kink number distribution in the transverse-field quantum Ising model. Kink statistics is described by the Poisson binomial distribution with all cumulants exhibiting a universal power law scaling with the quench rate. Lastly, in the absence of finite-size effects, the distribution approaches a normal one, a feature that is expected to apply broadly in systems described by the Kibble-Zurek mechanism.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Nonthermal States Arising from Confinement in One and Two Dimensions

We show that confinement in the quantum Ising model leads to nonthermal eigenstates, in both continuum and lattice theories, in both one (1D) and two dimensions (2D). In the ordered phase, the presence of a confining longitudinal field leads to a profound restructuring of the excitation spectrum, with the low-energy two-particle continuum being replaced by discrete “meson” modes (linearly confined pairs of domain walls). These modes exist far into the spectrum and are atypical, in the sense that expectation values in the state with energy $E$ do not agree with the microcanonical (thermal) ensemble prediction. Single meson states persist above the two-meson threshold due to a surprising lack of hybridization with the (n ≥ 4)-domain wall continuum, a result that survives into the thermodynamic limit and that can be understood from analytical calculations. The presence of such states is revealed in anomalous postquench dynamics, such as the lack of a light cone, the suppression of the growth of entanglement entropy, and the absence of thermalization for some initial states. In conclusion, the nonthermal states are confined to the ordered phase—the disordered (paramagnetic) phase exhibits typical thermalization patterns in both 1D and 2D in the absence of integrability.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗