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At least 991 records · Page 55

The future of the correlated electron problem

A central problem in modern condensed matter physics is the understanding of materials with strong electron correlations. Despite extensive work, the essential physics of many of these systems is not understood and there is very little ability to make predictions in this class of materials. In this manuscript we share our personal views on the major open problems in the field of correlated electron systems. We discuss some possible routes to make progress in this rich and fascinating field. This manuscript is the result of the vigorous discussions and deliberations that took place at Johns Hopkins University during a three-day workshop January 27, 28, and 29, 2020 that brought together six senior scientists and 46 more junior scientists. Our hope, is that the topics we have presented will provide inspiration for others working in this field and motivation for the idea that significant progress can be made on very hard problems if we focus our collective energies.

Alexandradinata, Aris [Univ. of Illinois at Urbana↗

Di-$\pi^0$ correlations in p+p, p+Al and p+Au collisions at $\sqrt{s_{NN}}$ = 200 GeV at STAR

The STAR Collaboration reports measurements of back-to-back azimuthal correlations of di- \pi^0 π 0 produced at forward pseudorapidity ( 2.6<\eta<4.0 2.6 < η < 4.0 ) in p+ p + p p , p+ p + \mathrm{Al} A l and p+ p + \mathrm{Au} A u collisions at a center-of-mass energy per nucleon-nucleon pair of 200 GeV. A clear suppression of the correlated away-side yields is observed in p+ p + \mathrm{Au} A u and for the first time in p+ p + \mathrm{Al} A l collisions, compared with the p p + + p p data. The enhanced suppression found in p+ p + \mathrm{Au} A u with respect to p+ p + \mathrm{Al} A l collisions exhibits the saturation scale ( Q_s^2 Q s 2 ) dependence on the mass number A A . The observed suppression of back-to-back pairs as a function of event activity and transverse momentum points to non-linear gluon dynamics arising at high parton densities.

Chu, Xiaoxuan↗

Measurement of Transverse Spin Dependent Azimuthal Correlations of Charged Pion(s) in $p^{\uparrow} p$ Collisions at $\sqrt s = 200$ GeV at STAR

At the leading twist, the transversity distribution function, h^{q}_{1}(x) h 1 q ( x ) , where x x is the longitudinal momentum fraction of the proton carried by quark q q , encodes the transverse spin structure of the nucleon. Extraction of it is difficult because of its chiral-odd nature. In transversely polarized proton-proton collisions ( p^\uparrow p p ↑ p ), h_{1}^{q}(x) h 1 q ( x ) can be coupled with another chiral-odd partner, a spin-dependent fragmentation function (FF). The resulting asymmetries in hadron(s) azimuthal correlations directly probe h_{1}^{q}(x) h 1 q ( x ) . We report the measurement of correlation asymmetries for charged pion(s) in p^\uparrow p p ↑ p , through the Collins and the Interference FF channel.

Pokhrel, Babu↗

Impact parameter dependence of color charge correlations in the proton

The impact parameter dependence of color charge correlators in the proton is obtained from the light front formalism in light cone gauge. We include NLO corrections due to the |qqqg\rangle | q q q g ⟩ Fock state via light-cone perturbation theory. Near the center of the proton, the b b -dependence of the correlations is very different from a ``transverse profile function’’. The resulting t t -dependence of exclusive J/\Psi J / Ψ photoproduction transitions from exponential to power law at |t| \approx 1 | t | ≈ 1 ~GeV ^2 2 . This prediction could be tested at upcoming DIS facilities or in nucleus-proton ultraperipheral collisions (UPCs).

Dumitru, Adrian↗

Eddy Correlation Flux Measurement System (ECOR) Instrument Handbook

The eddy correlation (ECOR) flux measurement system provides in situ, half-hour measurements of the surface turbulent fluxes of momentum, sensible heat, latent heat, and carbon dioxide (CO 2 ) (and methane at the U.S. Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) user facility’s North Slope of Alaska central facility [NSA Barrow], and at the ARM Mobile Facility (AMF) deployment at Oliktok Point). The fluxes are obtained with the eddy covariance technique, which involves correlation of the vertical wind component with the horizontal wind component, the air temperature, the water vapor density, and the CO 2 concentration. The instruments used are: a fast-response, three-dimensional (3D) wind sensor (sonic anemometer) to obtain the orthogonal wind components and the speed of sound (SOS) (used to derive the air temperature), an open-path infrared gas analyzer (IRGA) to obtain the water vapor density and the CO 2 concentration, and an open-path infrared gas analyzer (IRGA) to obtain methane density and methane flux at NSA Barrow and at the AMF deployment at Oliktok Point. The ECOR systems are deployed at the locations where other methods for surface flux measurements (e.g., energy balance Bowen ratio [EBBR] systems) are difficult to employ, primarily at the north edge of a field of crops. A surface energy balance system (SEBS) has been installed collocated with each deployed ECOR system in SGP, NSA, Tropical Western Pacific (TWP), and each of three ARM Mobile Facilities. The surface energy balance system consists of upwelling and downwelling solar and infrared radiometers within one net radiometer, a wetness sensor, and soil measurements. Finally, the SEBS measurements allow the comparison of ECOR sensible and latent heat fluxes with the energy balance determined from the SEBS and provide information on wetting of the sensors for data quality purposes.

47 OTHER INSTRUMENTATION↗

Multi-scale experimental study of creep-fatigue failure initiation in a 709 Stainless Steel alloy using high resolution digital image correlation. Final report

This report discusses the efforts made towards the multi-scale study of the creep-fatigue response of stainless steel 709. Multiple experimental techniques, including digital image correlation (DIC) and electron backscatter diffraction (EBSD), were used in assessing the evolution of damage accumulation during fatigue, creep-fatigue, and thermomechanical fatigue of alloy 709. The role of microstructural features, hold times, temperature, and loading profiles were quantified and the interchangeability of temperature and time was investigated. Finally, a thermomechanical fatigue model was shown to predict well the failure of samples with varying loading profiles. Results indicate that strain accumulation in 709 steel happens primarily near grain boundaries (GBs) with the strains around GBs being inversely proportional to their measured residual burgers vector. Furthermore, hot-spots for strain accumulation were shown to be the locations of eventual microcrack nucleation. The introduction of hold times to the periodic loading cycle increases the damage accumulation rate and thus shortens the fatigue life of samples–this was true for both room temperature and high temperature. Thermomechanical cycling was shown to have little effect on the end life of samples, with the damage accumulation rate for in-phase and out-of-phase cycling being similar to isothermal fatigue. The interchangeability of time and temperature was shown to be possible within the studied load, time, and temperature ranges, since deformation mechanisms driving strain accumulation did not change with temperature (up to 650°C). The Neu-Sehitoglu thermomechanical fatigue model, with constants obtained from the literature and in part from our experimental results, was applied to predict failure of isothermal creep-fatigue samples. The main objectives of this work were to:(a) Perform high-resolution digital image correlation measurements (HiDIC) for alloy 709; (b) Quantify and assess damage accumulation at the microstructure under fatigue, TMF, and creep-fatigue conditions of 709; (c) Study of the role of hold times, i.e., adding a creep component, to: Room temperature cycling, High temperature cycling, Failure; (d) Study the mechanisms of thermomechanical fatigue in this alloy; (e) Investigate the existence of a time-temperature interchangeability criterion to aid in accelerated creep-fatigue testing; (f) Establish the validity of a combined creep-fatigue model for life prediction for 709. This report is structured with each subsequent section detailing the efforts, results, and conclusions related to each of the objectives described, mostly in chronological order.

36 MATERIALS SCIENCE↗

Applying Waveform Correlation to Mining Blasts Using a Global Sparse Network

Agencies that monitor for underground nuclear tests are interested in techniques that automatically characterize mining blasts to reduce the human analyst effort required to produce high-quality event bulletins. Waveform correlation is effective in finding similar waveforms from repeating seismic events, including mining blasts. We report the results of an experiment that uses waveform templates recorded by multiple International Monitoring System stations of the Comprehensive Nuclear-Test-Ban Treaty for up to 10 years prior to detect and identify mining blasts that occur during single weeks of study. We discuss approaches for template selection, threshold setting, and event detection that are specialized for mining blasts and a sparse, global network. We apply the approaches to two different weeks of study for each of two geographic regions, Wyoming and Scandinavia, to evaluate the potential for establishing a set of standards for waveform correlation processing of mining blasts that can be effective for operational monitoring systems with a sparse network. We compare candidate events detected with our processing methods to the Reviewed Event Bulletin of the International Data Centre to develop an intuition about potential reduction in analyst workload.

45 MILITARY TECHNOLOGY, WEAPONRY, AND NATIONAL DEF↗

Applying Waveform Correlation to Mining Blasts Using a Global Sparse Network

Agencies that monitor for underground nuclear tests are interested in techniques that automatically characterize mining blasts to reduce the human analyst effort required to produce high-quality event bulletins. Waveform correlation is effective in finding similar waveforms from repeating seismic events, including mining blasts. We report the results of an experiment that uses waveform templates recorded by multiple International Monitoring System stations of the Preparatory Commission for the Comprehensive Nuclear-Test-Ban Treaty Organization for up to 10 years prior to the time period of interest to detect and identify mining blasts that occur during single weeks of study. We discuss approaches for template selection, threshold setting, and event detection that are specialized for mining blasts and a sparse, global network. We apply the approaches to two different weeks of study for each of two geographic regions, Wyoming and Scandinavia, to evaluate the potential for establishing a set of standards for waveform correlation processing of mining blasts that can be effective for operational monitoring systems with a sparse network. We compare candidate events detected with our processing methods to the Reviewed Event Bulletin of the International Data Centre to develop an intuition about potential reduction in analyst workload.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗

Development and Implementation of Digital Image Correlation for Out-of-Cell Burst Testing

This report details the progress made towards utilizing in-situ methods to observe and quantify unirradiated Zircaloy-4 (Zr4) fuel cladding deformation during out-of-cell design basis accident conditions, specifically during loss-of-coolant accident (LOCA) burst testing in the Severe Accident Test Station at Oak Ridge National Laboratory. Digital image correlation (DIC) was implemented to calculate cladding strain during burst and infrared (IR) thermography was used to attempt a correlation of strain with temperature and to investigate thermal gradients. For both techniques, early experimentation revealed experimental modifications were necessary for implementation. For DIC, this manifested as shortened cladding lengths which could be centered in front of the viewing chamber bored through the IR furnace side, and for IR thermography this meant conducting burst tests in air without a reaction tube and the incorporation of a SiC shell to eliminate direct IR reflections from the tungsten lamps. In the following, the technical issues and subsequent origin of these modifications are discussed, laying the framework for a proof-of-concept DIC/IR characterization of a burst test in the final section.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Energy-Energy Correlators for Precision QCD

In this contribution to the Proceedings of the US Community Study on the Future of Particle Physics (Snowmass 2021) we review recent progress in the evaluation and application of the Energy-Energy Correlator (EEC) event shape observable in $e^+e^⁻$ annihilation, hadronic collisions, and deep inelastic scattering. The importance of EEC as a precision probe of the perturbative and non perturbative aspects of QCD dynamics is emphasized. It can be used to extract the strong coupling constant and to constrain TMD distribution functions. Closely related energy-correlation shape variables have also been used to tag boosted objects produced in high energy collisions. The opportunities to study EEC at the future Electron-Ion Collider are also highlighted.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

High Throughput Coefficient Thermal Expansion Testing Utilizing Digital Image Correlation

Dr. Fitzgerald, a postdoc at Sandia National Laboratories, works in a materials of mechanics group characterizing material properties of ductile materials. Her presentation focuses specifically on increasing throughput of coefficient of thermal expansion (CTE) measurements with the use of optical strain measurements, called digital image correlation (DIC). Currently, the coefficient of thermal expansion is found through a time intensive process called dilatometry. There are multiple types of dilatometers. One type, a double push rod mechanical dilatometer, uses and LVDT to measure the expansion of a specimen in one direction. It uses a reference material with known properties to determine the CTE of the specimen in question. Testing about 500 samples using the double push rod mechanical dilatometer would take about 2 years if testing Monday through Friday, because the reference material needs to be at a constant temperature and heating must done slowly to ensure no thermal gradients across the rod. A second type, scissors type dilatometer, pinches a sample using a “scissor-like” appendage that also uses a LVDT to measure thermal expansion as the sample is heated. Finally, laser dilatometry, was created to provide a non-contact means to measure thermal expansion. This process greatly reduces the time required to setup a measurement but is still only able to measure one sample at a time. The time required to test 500 samples gets reduced to 3.5 weeks. Additionally, to measure expansion in different directions, multiple lasers must be used. Dr. Fitzgerald solved this conundrum by using an optical measurement technique called digital image correlation to create strain maps in multiple orientations as well as measuring multiple samples at once. Using this technique, Dr. Fitzgerald can test 500 samples, conservatively, in 2 days.

36 MATERIALS SCIENCE↗

Simulating strongly correlated molecules with a superconducting quantum processor

Many of the biggest challenges in expanding the nation’s access to clean and low-cost energy resources are fundamentally chemistry or materials challenges. An important case is the development of new catalysts for the up-conversion of cheap and readily available materials such as methane or water into materials suitable for use as a fuel such as methanol or oxygen. To understand and exploit such processes, computer simulations of chemical reactions provide a natural complement to experimental studies. Unfortunately, most catalytic reactions involve so-called “strongly correlated” molecules which are notoriously difficult to study with simulation algorithms that can be executed on existing (classical) computers. The recent growth in quantum information science offers an alternative potential route for simulating these difficult systems. As a result, an increasing number of computational chemists are becoming interested in quantum computing. At the same time, quantum information scientists have identified chemistry simulation as a possible first demonstration of a quantum computer providing an improvement over a classical computer. The objective of this project is to accurately simulate strongly correlated molecules on a quantum processor. To meet the high challenges of this objective, new hybrid quantum/classical algorithms will be co-designed with advanced quantum gate developments and computed on customized quantum hardware. Some of the developed techniques will be transferable to study other molecular systems, while the project as a whole will help define better strategies for advancing the quantum simulation of matter more generally.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Memcomputing the Spectrum of Correlated Quantum Systems

The goals and objectives of the grant DE‐SC0020892 were to apply a new computing paradigm, MemComputing, to efficiently simulate properties of correlated quantum systems. The method has been applied to a wide set of problems ranging from quantum state tomography to finding the ground state of correlated systems. In all cases, substantial advantages compared to state-of-the-art approaches have been obtained. The project has also led to the suggestion of the transformer architecture (used nowadays in large-language models) as an efficient quantum state representation, and a better understanding of the role of memory in the generation of long-range order in neural networks. This grant has supported the work of a PhD student, inspired a new class on unconventional computing taught at the University of California, San Diego and has generated several peer-reviewed papers.

97 MATHEMATICS AND COMPUTING↗

Cross Correlating Cosmological Probes for Stage-IV Surveys

The next few years will be populated with Stage-IV cosmological surveys. This paper forecasts the cosmological information we expect to constrain using probes from the Rubin Observatory Legacy Survey of Space and Time (LSST) and CMB Stage-4 surveys. We explore the effectiveness of different large-scale-structure probes, including the power spectra of galaxy weak lensing, galaxy positions, Cosmic Microwave Background (CMB) lensing, and their cross-correlation. We use correlated lognormal simulations with the expected redshift distribution, number density of galaxies, and noise levels of the LSST survey, as well as CMB-S4 lensing simulations with anticipated noise levels, to obtain the expected error bars of each of the probes. We investigate the constraining power of the cosmological parameters for the individual probes and their combinations in an idealized scenario, where we do not account for astrophysical and observational parameters such as galaxy bias variations and photometric redshift uncertainties.

Gibbins, Grace↗

Time-dependent phenomena in correlated materials

Understanding time-dependent processes and light-matter interaction in strongly correlated materials, and the interplay between electronic, orbital, vibrational, and spin degrees of freedom, is a cornerstone of condensed matter. These mechanisms can be proven by measuring the response of the systems to time-dependent perturbations. The corresponding time scales are dictated by the way light couples to the different excitations, and how these excitations exchange energy and momentum. Our research advances our understanding of these processes, and the interpretation of different equilibrium and time-resolved spectroscopies. Our project encompasses two main themes: (i) developing and refining computational techniques to study non-equilibrium spectroscopies including non-perturbative effects and (ii) applications to non-equilibrium phenomena. We have developed a new computational approach that works directly in the time domain: by including all the degrees of freedom involved in the scattering process (e.g. electrons, photons, neutrons), we solve the time dependent problem: a faithful numerical simulation of the experiment. By measuring the energy and momentum of the outgoing particles, we can extract information about the energy and momentum absorbed by the system. Prior to our work, people attempting to model and calculate non-equilibrium spectral functions relied on a description of the scattering cross section based on a formulation in the frequency domain, a treatment that is extremely cumbersome and complex. Our technique works in and out of equilibrium and can reproduce spectra by several spectroscopic techniques, such as time-resolved photoemission, neutron scattering, Raman, X-ray spectroscopies (RIXS, Auger, XAS, XMCD), and, by not relying on analytical approximations, yields results that reveal novel overlooked transient mechanisms. These tools provide sorely needed intuition for understanding the phenomenology of strongly correlated materials and will help experimentalists in identifying signatures of relevant excitations in pump-probe experiments, such as those conducted in DOE supported facilities.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Speciation Correlations between Uranium and Iodine

The National Nuclear Security Administration’s Office of Conversion has been supporting development of molybdenum-99 production methods utilizing non-highly enriched uranium targets. One of the novel methods being considered is the use of an aqueous homogeneous subcritical system. Concerns about controlling potentially volatile radioiodine have led to efforts to characterize the iodine species in this system. This report examined the potential to characterize the chemical species of the iodine by correlating it with analyses of uranium, which is more ubiquitous in the target material and suitable for on-line monitoring. Direct measurement of the iodine species would be infeasible due to the difficulty in performing analyses. The use of chemometric modeling utilizing spectral analyses is viable for the uranium measurements, however, a better understanding of the radiolytic effects of neutrons and the corresponding relationship between uranium and iodine is required to correlate any measurements to iodine speciation.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

Holographic Quantum Simulation of Strongly Correlated Electron Systems

The project aimed to demonstrate a new holographic quantum simulation approach and co‐ designed quantum hardware to tackle three specific problems that fall within the broad umbrella of unraveling the physics of strongly correlated electron systems (SCES). These tasks were: (1) holographic preparation of ground‐ and thermal‐ states of correlated magnetic and electronic systems including quasi‐2d frustrated‐spin, Fermi‐Hubbard, and fractional quantum Hall (FQH) systems, (2) holographic‐simulation of long‐time out‐of‐equilibrium dynamics and (3) holographic analogs of embedding methods such as dynamical mean‐ field theory (DMFT) and density‐matrix embedding theory (DMET) to solve systems with complex structure or long‐range interactions. These tasks are prototypes for the kinds of material simulation problems of interest to BES, such as the simulation of multiferroic materials, perovskite photovoltaics and high‐temperature superconductors, that tax the capabilities of the most powerful classical supercomputers.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗