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DOE OSTI2024

Massive all-atom analysis of 2D materials with quantum properties (Final report)

Improvements in microscopy have enabled the acquisition of data at a scale that is difficult to process manually, making automated machine learning approaches to analyzing experimental images essential. In this project, we developed and applied machine learning (ML) workflows for atomic resolution scanning transmission electron microscopy (STEM) images. This development included improving both methodology as well as generating user-friendly codes. We developed machine learning architectures which, after training, automatically identify the location and types of defects throughout a material. We used these data to produce class-averaged images of 2D atomic coordinates with up to 0.3 pm precision, uncovering the structure and oscillations of long-range strain fields around point defects in WSe 2-2x Te 2x . We also resolved a long-standing problem in this field in the training of ML models, a lack of labeled experimental data, by developing a cycle-GAN that transformed simulated-generated labeled data into labeled data indistinguishable from experiment and therefore suitable for training. This removed the remaining parts of the ML data processing workflow where human intervention was still critical and therefore a bottleneck to working at scale. Codes have been developed and released for this full machine learning workflow. ML approaches to partially automate STEM acquisition were also developed. Finally we applied ML and other advanced data processing methods to several materials science problems in two-dimensional materials, including studying the evolution of hyperuniformity with defect concentration in WSe2, understanding phase transformations in transition metal dichalcogenides during in-situ heating in the STEM, and exploring how 2D interfaces transform from twisted into aligned structures.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

NASA NTRS2016

Manufacturing Challenges and Benefits When Scaling the HIAD Stacked-Torus Aeroshell to a 15m-Class System

HIAD↗

NASA NTRS2016

Manufacturing Challenges and Benefits when Scaling the HIAD Stacked-Torus Aeroshell to a 15m-Class System

Over a decade of work has been conducted in the development of NASAs Hypersonic Inflatable Aerodynamic Decelerator (HIAD) deployable aeroshell technology. This effort has included multiple ground test campaigns and flight tests culminating in the HIAD projects second generation (Gen-2) aeroshell system. The HIAD project team has developed, fabricated, and tested stacked-torus inflatable structures (IS) with flexible thermal protection systems (F-TPS) ranging in diameters from 3-6m, with cone angles of 60 and 70 deg. To meet NASA and commercial near term objectives, the HIAD team must scale the current technology up to 12-15m in diameter. Therefore, the HIAD projects experience in scaling the technology has reached a critical juncture. Growing from a 6m to a 15m-class system will introduce many new structural and logistical challenges to an already complicated manufacturing process.Although the general architecture and key aspects of the HIAD design scale well to larger vehicles, details of the technology will need to be reevaluated and possibly redesigned for use in a 15m-class HIAD system. These include: layout and size of the structural webbing that transfers load throughout the IS, inflatable gas barrier design, torus diameter and braid construction, internal pressure and inflation line routing, adhesives used for coating and bonding, and F-TPS gore design and seam fabrication. The logistics of fabricating and testing the IS and the F-TPS also become more challenging with increased scale. Compared to the 6m aeroshell (the largest HIAD built to date), a 12m aeroshell has four times the cross-sectional area, and a 15m one has over six times the area. This means that fabrication and test procedures will need to be reexamined to ac-count for the sheer size and weight of the aeroshell components. This will affect a variety of steps in the manufacturing process, such as: stacking the tori during assembly, stitching the structural webbing, initial inflation of tori, and stitching of F-TPS gores. Additionally, new approaches and hardware will be required for handling and ground testing of both individual tori and the fully assembled HIADs.There are also noteworthy benefits of scaling up the HIAD aeroshell to a 15m-class system. Two complications in working with handmade textile structures are the non-linearity of the material components and the role of human accuracy during fabrication. Larger, more capable, HIAD structures should see much larger operational loads, potentially bringing the structural response of the material components out of the non-linear regime and into the preferred linear response range. Also, making the reasonable assumption that the magnitude of fabrication accuracy remains constant as the structures grow, the relative effect of fabrication errors should decrease as a percentage of the textile component size. Combined, these two effects improve the predictive capability and the uniformity of the structural response for a 12-15m HIAD.In this presentation, a handful of the challenges and associated mitigation plans will be discussed, as well as an update on current 12m aeroshell manufacturing and testing that is addressing these challenges

Infatables↗

DOE OSTI2024

The crystal structure of Grindelia robusta 7,13-copalyl diphosphate synthase reveals active site features controlling catalytic specificity

Diterpenoid natural products serve critical functions in plant development and ecological adaptation and many diterpenoids have economic value as bioproducts. The family of class II diterpene synthases catalyzes the committed reactions in diterpenoid biosynthesis, converting a common geranylgeranyl diphosphate precursor into different bicyclic prenyl diphosphate scaffolds. Enzymatic rearrangement and modification of these precursors generate the diversity of bioactive diterpenoids. We report the crystal structure of Grindelia robusta 7,13-copalyl diphosphate synthase, GrTPS2, at 2.1 Å of resolution. GrTPS2 catalyzes the committed reaction in the biosynthesis of grindelic acid, which represents the signature metabolite in species of gumweed (Grindelia spp., Asteraceae). Grindelic acid has been explored as a potential source for drug leads and biofuel production. The GrTPS2 crystal structure adopts the conserved three-domain fold of class II diterpene synthases featuring a functional active site in the γβ-domain and a vestigial α-domain. Substrate docking into the active site of the GrTPS2 apo protein structure predicted catalytic amino acids. Biochemical characterization of protein variants identified residues with impact on enzyme activity and catalytic specificity. Specifically, mutagenesis of Y457 provided mechanistic insight into the position-specific deprotonation of the intermediary carbocation to form the characteristic 7,13 double bond of 7,13-copalyl diphosphate.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2015

Archaeal Inorganic Pyrophosphatase Displays Robust Activity under High-Salt Conditions and in Organic Solvents

Soluble inorganic pyrophosphatases (PPAs) that hydrolyze inorganic pyrophosphate (PP i ) to orthophosphate (P i ) are commonly used to accelerate and detect biosynthetic reactions that generate PP i as a by-product. Current PPAs are inactivated by high salt concentrations and organic solvents, which limits the extent of their use. Here we report a class A type PPA of the haloarchaeon Haloferax volcanii (HvPPA) that is thermostable and displays robust PP i -hydrolyzing activity under conditions of 25% (vol/vol) organic solvent and salt concentrations from 25 mM to 3 M. HvPPA was purified to homogeneity as a homohexamer by a rapid two-step method and was found to display non-Michaelis-Menten kinetics with a V max of 465 U · mg –1 for PP i hydrolysis (optimal at 42°C and pH 8.5) and Hill coefficients that indicated cooperative binding to PP i and Mg 2+ . Similarly to other class A type PPAs, HvPPA was inhibited by sodium fluoride; however, hierarchical clustering and three-dimensional (3D) homology modeling revealed HvPPA to be distinct in structure from characterized PPAs. In particular, HvPPA was highly negative in surface charge, which explained its extreme resistance to organic solvents. To demonstrate that HvPPA could drive thermodynamically unfavorable reactions to completion under conditions of reduced water activity, a novel coupled assay was developed; HvPPA hydrolyzed the PP i by-product generated in 2 M NaCl by UbaA (a “salt-loving” noncanonical E1 enzyme that adenylates ubiquitin-like proteins in the presence of ATP). Altogether, we demonstrate HvPPA to be useful for hydrolyzing PP i under conditions of reduced water activity that are a hurdle to current PPA-based technologies.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2023

Ga 4 C-family crystals, a new generation of star thermoelectric materials, achieved by band degeneracies, valley anisotropy, and strong phonon scattering among others

Using density functional theory combined with the Boltzmann transport equation, we uncover a new class of high-performance thermoelectric materials, i.e., supertetrahedral Ga 4 C-family materials characterized by an ultrahigh thermoelectric figure of merit (ZT), which is produced both by a large power factor and ultralow lattice thermal conductivity. The former is contributed by multiple electronic band degeneracies, flat bands and valley anisotropy, while the latter is contributed both by strong phonon scattering and low phonon group velocity. Furthermore, we find that tensile strain engineering may further suppress lattice thermal conductivity, while well retaining the multi-band degeneracies, valley anisotropy and flat bands. In addition to the band degeneracy, the scattering mechanism of the system can also dominate the power factor in the process of strain implementation. Consequently, a novel thermoelectric phenomenon, i.e., a high thermoelectric figure of merit, is observed in Ca 4 C with a ZT value larger than 4.4 under a small strain ratio (0.75%). In conclusion, our theoretical studies not only uncover a new class of high-performance thermoelectric materials integrating multiple effective mechanisms, but also establish a realistic material plateau to investigate the competitive effect of multiple factors on enhancing the thermoelectric figure of merit.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2019

Directed Hydrogen Bond Placement: Low Viscosity Amine Solvents for CO2 Capture

Capture of CO2 from power generation is required for its conversion or sequestration. Toward this goal, numerous CO2 capture processes have been developed, with the most widely deployed technology utilizing aqueous solutions of amines. Our group has focused on the design of several classes of water-lean solvents in order to identify molecular-level descriptors to control materials properties such as viscosity and regeneration energy. Large scale molecular simulations have shown that strategic placement of hydrogen bonding and tuning of the acid/base equilibria are critical for controlling viscosity at CO2-rich loadings. Here, we extend these principles to a new class of pyridine-based molecules with a secondary amine functionality for binding CO2. The result is a class of water-lean amines that retain high gravimetric capacity (20%) while exhibiting the lowest CO2-rich viscosities (<150 cP, 40 °C) of any 100% concentrated amine currently known. Additionally, these newly identified solvents exhibit regeneration temperatures as low as 60 °C when applying a polarity swing assisted regeneration, resulting in a solvent that can conceptually absorb and desorb CO2 with only a 20 °C temperature swing.

Malhotra, Deepika↗

NASA NTRS1987

Two-phase measurements of a spray in the wake of a bluff body

The dynamics of spray drop interaction with the turbulent, recirculating wake of a flat disk bluff body were investigated using a phase Doppler particle analyzer to determine drop size and velocity and the gas-phase velocity. Detailed measurements obtained included spray drop size, axial and radial velocity, angle of trajectory, and size-velocity correlations. The gas-phase velocity was determined from seeding of the two-phase flow. Results showed dramatic differences in drop behavior for various size classes when interacting with the turbulent flow field. Small drops were quickly entrained and recirculated, while initially, the larger drops continued in the general direction of the spray cone. Further downstream, significant numbers of large drops recirculated, generating a bifurcated size-velocity correlation. These lateral convections and streamwise accelerations and decelerations strongly influenced the number density along with size and velocity distributions. The complex interaction of the spray with the turbulent air-flow points out the need for spatially-resolved measurements that determine drop behavior for individual size classes, rather than characterizing a spray only via simple integral quantities such as the Sauter mean diameter.

Rudoff, R. C.↗

NASA NTRS2009

Lossless Compression of Classification-Map Data

A lossless image-data-compression algorithm intended specifically for application to classification-map data is based on prediction, context modeling, and entropy coding. The algorithm was formulated, in consideration of the differences between classification maps and ordinary images of natural scenes, so as to be capable of compressing classification- map data more effectively than do general-purpose image-data-compression algorithms. Classification maps are typically generated from remote-sensing images acquired by instruments aboard aircraft (see figure) and spacecraft. A classification map is a synthetic image that summarizes information derived from one or more original remote-sensing image(s) of a scene. The value assigned to each pixel in such a map is the index of a class that represents some type of content deduced from the original image data for example, a type of vegetation, a mineral, or a body of water at the corresponding location in the scene. When classification maps are generated onboard the aircraft or spacecraft, it is desirable to compress the classification-map data in order to reduce the volume of data that must be transmitted to a ground station.

Hua, Xie↗

DOE OSTI2013

Project X: Accelerator Reference Design

Project X is a high-intensity proton facility being developed to support a world-leading program of Intensity Frontier physics over the next two decades at Fermilab. Project X is an integral part of the U.S. Intensity Frontier Roadmap as described in the P5 report of May 2008 [1] and within the Fermilab Strategic Plan of November 2011 [2]. This document represents Part I of the “Project X Book” describing the Project X accelerator facility and the broad range of physics research opportunities enabled by Project X. Parts II and III provide in-depth descriptions of the physics research program, both within and beyond particle physics [3]. The primary elements of the U.S. program to be supported by Project X include: Neutrino Experiments: Experimental studies of neutrino oscillations and neutrino interaction physics with ultra-intense neutrino beams provided by a high-power proton source with energies up to 120 GeV, utilizing near detectors at the Fermilab site and massive detectors at distant underground laboratories. Goal: At least 2 MW of proton beam power at any energy between 60 to 120 GeV; several hundred kW of proton beam power on target at 8 GeV. Kaon, Muon, Nucleon, and Neutron Precision Experiments: World-leading experiments studying ultra-rare kaon decays, searching for muon-to-electron conversion and nuclear electron dipole moments (EDMs), and exploring neutron properties at very high precision. Goal: MW-class proton beams supporting multiple experiments at 1 and 3 GeV, with flexible capability for providing distinct beam formats to concurrent users while allowing simultaneous operations with the neutrino program. Material Science and Nuclear Energy Applications: High-intensity accelerator, spallation, target and transmutation technology demonstrations will provide critical input into the design of future energy systems, including next generation fission reactors, nuclear waste transmutation systems and future thorium fuel-cycle power systems. Possible applications of muon spin rotation techniques provide sensitive probes of the magnetic structure of materials. Goal: Provide MW-class proton beams at 1 GeV, coupled with novel targets required to support a broad range of materials science and energy applications. Platform for Evolution to Future Frontier Facilities: A high-intensity proton source will strengthen and modernize the Fermilab injector complex, providing a robust platform upon which to build future frontier facilities. The Neutrino Factory and Muon Collider are examples that would provide world-leading capabilities at the Intensity and Energy Frontiers for many decades to come. Goal: Provide a straightforward upgrade path for a 4 MW, low-duty-factor source of protons at energies between 5 and 15 GeV. These four elements are expected to form the basis of the Mission Need statement required for the Department of Energy (DOE) Critical Decision 0 (CD-0), and represent the fundamental design criteria for Project X. The following chapters present the Reference Design for the Project X accelerator facility. The Reference Design is based on a continuous wave (CW) superconducting (SC) linac providing up to 1 and 3 MW of beam power at 1 and 3 GeV respectively. A pulsed linac provides acceleration of roughly 4% of the beam delivered from the CW linac to the 8 GeV injection energy of the existing Recycler/Main Injector complex. Upgrades to the Recycler and Main Injector support a factor of three increase, beyond current capabilities, in proton beam power at 60 to 120 GeV. The Reference Design represents a facility that will be unique in the world with unmatched capabilities for the delivery of very high beam power, with flexible beam formats, to multiple users at multiple energies. The utilization of linacs within the Project X facility enables capabilities beyond what is achievable with circular accelerators. It is anticipated that the final configuration and operating parameters of the complex will be further refined through the R&D program in advance of CD-2.

Holmes, Stephen D.↗

NASA NTRS2016

Manufacturing Challenges and Benefits when Scaling the HIAD Stacked-Torus Aeroshell to a 15m Class System

Over a decade of work has been conducted in the development of NASA's Hypersonic Inflatable Aerodynamic Decelerator (HIAD) deployable aeroshell technology. This effort has included multiple ground test campaigns and flight tests culminating in the HIAD project's second generation (Gen-2) aeroshell system. The HIAD project team has developed, fabricated, and tested stacked-torus inflatable structures (IS) with flexible thermal protection systems (F-TPS) ranging in diameters from 3-6m, with cone angles of 60 and 70 deg. To meet NASA and commercial near term objectives, the HIAD team must scale the current technology up to 12-15m in diameter. The HIAD project's experience in scaling the technology has reached a critical juncture. Growing from a 6m to a 15m class system will introduce many new structural and logistical challenges to an already complicated manufacturing process. Although the general architecture and key aspects of the HIAD design scale well to larger vehicles, details of the technology will need to be reevaluated and possibly redesigned for use in a 15m-class HIAD system. These include: layout and size of the structural webbing that transfers load throughout the IS, inflatable gas barrier design, torus diameter and braid construction, internal pressure and inflation line routing, adhesives used for coating and bonding, and F-TPS gore design and seam fabrication. The logistics of fabricating and testing the IS and the F-TPS also become more challenging with increased scale. Compared to the 6m aeroshell (the largest HIAD built to date), a 12m aeroshell has four times the cross-sectional area, and a 15m one has over six times the area. This means that fabrication and test procedures will need to be reexamined to account for the sheer size and weight of the aeroshell components. This will affect a variety of steps in the manufacturing process, such as: stacking the tori during assembly, stitching the structural webbing, initial inflation of tori, and stitching of F-TPS gores. Additionally, new approaches and hardware will be required for handling and ground testing of both individual tori and the fully assembled HIADs. There are also noteworthy benefits of scaling up the HIAD aeroshell to 15m-class system. Two complications in working with handmade textiles structures are the non-linearity of the materials and the role of human accuracy during fabrication. Larger, more capable, HIAD structures should see much larger operational loads, potentially bringing the structural response of the materials out of the non-linear regime and into the preferred linear response range. Also, making the reasonable assumption that the magnitude of fabrication accuracy remains constant as the structures grow, the relative effect of fabrication errors should decrease as a percentage of the textile component size. Combined, these two effects improve the predictive capability and the uniformity of the structural response for a 12-15m class HIAD. In this paper, the challenges and associated mitigation plans related to scaling up the HIAD stacked-torus aeroshell to a 15m class system will be discussed. In addition, the benefits of enlarging the structure will be further explored.

Decellerators↗

DOE OSTI2019

b - τ Yukawa unification in SUSY SU(5) with mirage mediation: LHC and dark matter implications

We consider a class of b - τ Yukawa unified Supersymmetric (SUSY) SU(5) GUTs, in which the asymptotic gaugino M 1,2,3 masses are generated through the mirage mediated supersymmetry breaking, which is a combination of the gravity and anomaly mediation. Due to the contributions from the anomaly contribution, M 3 is always lighter than M 1 and M 2 , and consequently for the range of asymptotic masses considered, the gluino mass \( {m}_{\tilde{g}} \) at low scale is bounded from above at about 4 TeV. We realize two different regions, in one of which the MSSM μ -term is less than about 3 TeV. This region yields a stop mass up to 5 TeV, and the stop mass is nearly degenerate with the LSP neutralino for mass around 0.8 to 1.7 TeV. A stau mass can be realized up to about 5 TeV, and the stau mass is approximately degenerate with the LSP neutralino for mass around 2 to 3 TeV. In addition, an A-funnel solution with \( {m}_A\approx 2{m}_{{\tilde{\chi}}_1^0} \) and \( {m}_{{\tilde{\chi}}_1^0}\sim 700-900 \) GeV is realized. These three cases yield LSP dark matter abundance in accordance with observations. A second region, on the other hand, arises for \( {m}_{\tilde{g}}\lesssim 1.1{m}_{{\tilde{\chi}}_1^0} \) . The μ -term is rather large (≳20 TeV), and the LSP neutralino is a bino-wino mixture. The gluino mass (~ 0 . 8-1 . 2 TeV) is nearly degenerate with the LSP neutralino mass and hence, the gluino-neutralino coannihilation processes play a role in reducing the relic abundance of LSP neutralino down to ranges allowed by the current WMAP measurements. The two regions above can be distinguished through the direct detection experiments. The first region with relatively low μ values yields Higgsino-like DM, whose scattering on the nucleus typically has a large cross-section. We find that such solutions are still allowed by the current results from the LUX experiment, and they will be severely tested by the LUX-Zeplin (LZ) experiment. The second region contains bino-wino DM whose scattering cross-section is relatively low. These solutions are harder to rule out in the foreseeable future.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2024

Towards natural and realistic E 7 GUTs in F-theory

We consider phenomenological aspects of a natural class of Standard Model-like supersymmetric F-theory vacua realized through flux breaking of rigid E 7 gauge factors. Three generations of Standard Model matter are realized in many of these vacua. We further find that many other Standard Model-like features are naturally compatible with these constructions. For example, dimension-4 and 5 terms associated with proton decay are ubiquitously suppressed. Many of these features are due to the group theoretical structure of E 7 and associated F-theory geometry. In particular, a set of approximate global symmetries descends from the E 7 group, leading to exponential suppression of undesired couplings.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2016

Multi-objective optimization techniques to design the Pareto front of organic dielectric polymers

Here, we present two Monte Carlo algorithms to find the Pareto front of the chemical space of a class of dielectric polymers that is most interesting with respect to optimizing both the bandgap and dielectric constant. Starting with a dataset generated from density functional theory calculations, we used machine learning to construct surrogate models for the bandgaps and dielectric constants of all physically meaningful 4-block polymers (that is, polymer systems with a 4-block repeat unit). We parameterized these machine learning models in such a way that the surrogates built for the 4-block polymers were readily extendable to polymers beyond a 4-block repeat unit. By using translational invariance, chemical intuition, and domain knowledge, we were able to enumerate all possible 4, 6, and 8 block polymers and benchmark our Monte Carlo sampling of the chemical space against the exact enumeration of the surrogate predictions. We obtained exact agreement for the fronts of 4-block polymers and at least a 90% agreement for those of 6 and 8-block polymers. We present fronts for 10-block polymer that are not possible to obtain by direct enumeration. We note that our Monte Carlo methods also return polymers close to the predicted front and a measure of the closeness. Both quantities are useful information for the design and discovery of new polymers.

36 MATERIALS SCIENCE↗

DOE OSTI2015

Rescuing Those Left Behind: Recovering and Characterizing Underdigested Membrane and Hydrophobic Proteins To Enhance Proteome Measurement Depth

The marine archaeon Nanoarchaeum equitans is dependent on direct physical contact with its host, the hyperthermophile Ignicoccus hospitalis. It is thought that this interaction is membrane-associated, involving a myriad of membrane-anchored proteins; proteomic efforts to better characterize this difficult to analyze interface are paramount to uncovering the mechanism of their association. By extending multienzyme digestion strategies that use sample filtration to recover underdigested proteins for reprocessing/consecutive proteolytic digestion, we applied chymotrypsin to redigest the proteinaceous material left over after initial proteolysis with trypsin of sodium dodecyl sulfate (SDS)-extracted I. hospitalis-N. equitansproteins. We show that proteins with increased hydrophobic character, including membrane proteins with multiple transmembrane helices, are enriched and recovered in the underdigested fraction. Chymotryptic reprocessing provided significant sequence coverage gains in both soluble and hydrophobic proteins alike, with the latter benefiting more so in terms of membrane protein representation. Moreover, these gains were despite a large proportion of high-quality peptide spectra remaining unassigned in the underdigested fraction suggesting high levels of protein modification on these often surface-exposed proteins. Importantly, these gains were achieved without applying extensive fractionation strategies usually required for thorough characterization of membrane-associated proteins and were facilitated by the generation of a distinct, complementary set of peptides that aid in both the identification and quantitation of this important, under-represented class of proteins.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2015

Orientational order of motile defects in active nematics

The study of equilibrium liquid crystals has led to fundamental insights into the nature of ordered materials, as well as many practical applications such as display technologies. Active nematics are a fundamentally different class of liquid crystals, which are driven away from equilibrium by the autonomous motion of their constituent rodlike particles. This internally-generated activity powers the continuous creation and annihilation of topological defects, leading to complex streaming flows whose chaotic dynamics appear to destroy long-range order. Here, we study these dynamics in experimental and computational realizations of active nematics. By tracking thousands of defects over centimeter distances in microtubule-based active nematics, we identify a non-equilibrium phase characterized by system-spanning orientational order of defects. This emergent order persists over hours despite defect lifetimes of only seconds. Lastly, similar dynamical structures are observed in coarse-grained simulations, suggesting that defect-ordered phases are a generic feature of active nematics.

36 MATERIALS SCIENCE↗

DOE OSTI2013

Robustness of predator-prey models for confinement regime transitions in fusion plasmas

Energy transport and confinement in tokamak fusion plasmas is usually determined by the coupled nonlinear interactions of small-scale drift turbulence and larger scale coherent nonlinear structures, such as zonal flows, together with free energy sources such as temperature gradients. Zero-dimensional models, designed to embody plausible physical narratives for these interactions, can help to identify the origin of enhanced energy confinement and of transitions between confinement regimes. A prime zero-dimensional paradigm is predator-prey or Lotka-Volterra. Here, we extend a successful three-variable (temperature gradient; microturbulence level; one class of coherent structure) model in this genre [M. A. Malkov and P. H. Diamond, Phys. Plasmas 16, 012504 (2009)], by adding a fourth variable representing a second class of coherent structure. This requires a fourth coupled nonlinear ordinary differential equation. We investigate the degree of invariance of the phenomenology generated by the model of Malkov and Diamond, given this additional physics. We study and compare the long-time behaviour of the three-equation and four-equation systems, their evolution towards the final state, and their attractive fixed points and limit cycles. We explore the sensitivity of paths to attractors. It is found that, for example, an attractive fixed point of the three-equation system can become a limit cycle of the four-equation system. Addressing these questions which we together refer to as 'robustness' for convenience is particularly important for models which, as here, generate sharp transitions in the values of system variables which may replicate some key features of confinement transitions. Our results help to establish the robustness of the zero-dimensional model approach to capturing observed confinement phenomenology in tokamak fusion plasmas.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2015

Evaluation of thermal gradients in longitudinal spin Seebeck effect measurements

In the framework of the longitudinal spin Seebeck effect (LSSE), we developed an experimental setup for the characterization of LSSE devices. This class of device consists in a layered structure formed by a substrate, a ferrimagnetic insulator (YIG) where the spin current is thermally generated, and a paramagnetic metal (Pt) for the detection of the spin current via the inverse spin-Hall effect. In this kind of experiments, the evaluation of a thermal gradient through the thin YIG layer is a crucial point. In this work, we perform an indirect determination of the thermal gradient through the measurement of the heat flux. We developed an experimental setup using Peltier cells that allow us to measure the heat flux through a given sample. In order to test the technique, a standard LSSE device produced at Tohoku University was measured. We find a spin Seebeck S{sub SSE} coefficient of 2.8×10{sup −7} V K{sup −1}.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗