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At least 1,423 records · Page 79

Organophilic, Superparamagnetic, and Reversibly Thermoresponsive Silica-Polypeptide Core–Shell Particles

Particles with a superparamagnetic cobalt inner core, silica outer core, and covalently bound homopolypeptide shell were investigated under thermal and magnetic stimuli. The homopolypeptide was poly(ε-carbobenzyloxy- l -lysine), PCBL, which is known to exhibit a thermoreversible coil ⇔ helix transition when dissolved as a pure polymer in m- cresol. Tethering to a core particle did not prevent PCBL from undergoing this conformational transition, as confirmed by dynamic light scattering and optical rotation, but the transition was broadened compared to that of the untethered polymer. The Co@SiO 2 -PCBL hybrid particles retained the superparamagnetic properties of the cobalt inner nougat. Indeed, some response remains even after aging for >5 years. The aged PCBL shell also preserved its responsiveness to temperature, although differences in the shape of the size vs temperature transition curve were determined compared to the freshly made particles. A reversible coil ⇔ helix transition for a particle-bound polypeptide in a pure organic solvent is rare. Further to providing a convenient tool for characterizing coil ⇔ helix transitions for surface-bound polypeptides without interference from pH or the strong ionic forces that dominate behavior in aqueous systems, the Co@SiO 2 -PCBL/ m -cresol system may prove useful in studies of the effect of shell polymer conformation on colloid interactions. The stability of the magnetic core and polypeptide shell suggest a long shelf life for Co@SiO 2 -PCBL, which can, in principle, be deprotected to yield positively charged Co@SiO 2 -poly( l -lysine) particles for possible transfection or antimicrobial applications or chained magnetically to produce responsive poly(colloids).

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Blade-Type Reaction Front in Micrometer-Sized Germanium Particles during Lithiation

To investigate the lithium transport mechanism in micrometer-sized germanium (Ge) particles, in situ focused ion beam-scanning electron microscopy was used to monitor the structural evolution of individual Ge particles during lithiation. Our results show that there are two types of reaction fronts during lithiation, representing the differences of reactions on the surface and in bulk. Further, the cross-sectional SEM images and transmission electron microscopy characterizations show that the interface between amorphous Li x Ge and Ge has a wedge shape because of the higher Li transport rate on the surface of the particle. The blade-type reaction front is formed at the interface of the amorphous Li x Ge and crystalline Ge and is attributed to the large strain at the interface.

25 ENERGY STORAGE↗

Multiplicity dependence of light-flavor hadron production in p p collisions at s = 7 TeV

Comprehensive results on the production of unidentified charged particles, $π^±, K^±, K^0_S, K^*(892)^0, p,$ $\bar{p}$, $\phi$ (1020), Λ, $\bar{Λ}$, $\Xi^-$, $\bar{\Xi}^+$, $Ω^-$, and $\bar{Ω}^+$ hadrons in proton-proton ($pp$) collisions at $\sqrt{s}$ = 7 TeV at midrapidity ($|y|$ < 0.5) as a function of charged-particle multiplicity density are presented. In order to avoid autocorrelation biases, the actual transverse momentum ($p$ T ) spectra of the particles under study and the event activity are measured in different rapidity windows. In the highest multiplicity class, the charged-particle density reaches about 3.5 times the value measured in inelastic collisions. While the yield of protons normalized to pions remains approximately constant as a function of multiplicity, the corresponding ratios of strange hadrons to pions show a significant enhancement that increases with increasing strangeness content. Furthermore, all identified particle-to-pion ratios are shown to depend solely on charged-particle multiplicity density, regardless of system type and collision energy. The evolution of the spectral shapes with multiplicity and hadron mass shows patterns that are similar to those observed in $p$-Pb and Pb-Pb collisions at Large Hadron Collider energies. The obtained $p$ T distributions and yields are compared to expectations from QCD-based $pp$ event generators as well as to predictions from thermal and hydrodynamic models. These comparisons indicate that traces of a collective, equilibrated system are already present in high-multiplicity $pp$ collisions.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Roll-to-Roll Advanced Materials Manufacturing DOE Laboratory Collaboration - FY2018 Final Report

High-value R2R processing is used to support a wide range of products in applications which span many industrial business sectors. The overall R2R process technology can be considered as “mature” as the process methodology and has been in use for decades. This continuous processing technique traditionally involves deposition of material(s) onto moving webs or carriers or other continuous R2R, belt-fed, or conveyor-based processes that enable successive steps to build a final version which serves to support the deposited materials. Current process technologies, which typify “roll to roll”, include tape casting, silk-screen printing, reel-to-reel vacuum deposition/coating and R2R lithography. Products supported by R2R manufacturing include micro-electronics, electro-chromic window films, PVs, fuel cells for energy conversion, battery electrodes for energy storage, and barrier materials. Due to innovation in materials and process equipment, high-quality yet very low-cost multi-layer technologies can be manufactured on a very cost-competitive basis. To move energy-related products from high-cost niche applications to the commercial sector, a means must be available to enable manufacture of these products in a cost-competitive manner that is affordable by the general consumer. Fortunately, products such as fuel cells, thin- and mid-film PVs, batteries, electrochromic and piezoelectric films, water separation membranes, and other energy saving technologies readily lend themselves to manufacture using R2R approaches.Within the DOE EERE AMO, it was recognized that establishment of a program supported at the DOE National Laboratories, along with their immense design of materials and equipment modelling capabilities enabled with use of high-performance computing, could take advantage of available R2R infrastructure to manufacture new technologies. In FY 2016, a R2R Consortium was established and provided with initial “seed” funding to take an approach that was envisioned to be supportable by advanced manufacturing R2R processes. This collaborative approach was designed to foster identification and development of materials and processes related to R2R for clean-energy product development. Using computational and experimental capabilities by acknowledged subject matter experts within the supported National Laboratory system, this collaborative project would leverage the capabilities and expertise at each of four laboratories to further the development of an enabling high-volume cost-competitive platform technology. The collaboration team that is comprised of ORNL, ANL, NREL and LBNL, coordinating with EPB and other selected industry partners, was formed in April 2016 to initially address enhancing battery electrode performance and R2R manufacturing challenges. The research efforts were to predict and measure changes and results in electrode morphology and performance based on process condition changes; to evaluate mixed, active, particle size deposition and drying for novel electrode materials; to model various process condition changes and the resulting morphology and electrode performance; and to develop and validate NDE techniques for in-line measurement of battery electrode material properties. These efforts carried through FY 2017 and completed at the end of FY 2018.The approach was to look at compositions of materials with different particle sizes to make electrode samples using a R2R manufacturing process. The shape, size, and morphology of the materials, the chemistry of the formulation, the nature of slurries, their coating rate, the rate of drying all play a role in determining the final coating architecture, quality, and performance. A commercial cathode material was selected to make a series of cathodes and anodes by single pass, dual pass and slot die methods. Analysis of all the compiled results for this battery electrode development were that the best performing cathodes included: dual-pass electrode with large particles near the foil, mixed small and large particles, and small particles only. Whereas, the best performing anodes were with a mix of small and large graphite particles. An additional core project was added in FY 2017 to conduct studies of fuel cell materials that can be produced using R2R processes. The goal of this project is to explore, understand and optimize material and process parameters to support increased throughput, increased quality, and reduced cost for high volume production of gas-diffusion electrodes (GDEs) for PEMFCs. Project work in FY 2018 were to use a R2R process to fabricate electrodes without ionomer overlayer that can produce the equivalent mass activity as spray-coated electrodes with an ionomer overlayer. Oxygen-limiting current measurements were utilized to optimize oxygen mass transport. Alcohol-rich solvents were investigated, and results were that the alcohol and water ratio can be tuned to control ionomer distribution. Water-rich solvents produce a more dispersed ink which results in better high-current density performance.

36 MATERIALS SCIENCE↗

Tailoring Morphology of Cu–Ag Nanocrescents and Core–Shell Nanocrystals Guided by a Thermodynamic Model

The ability to predict and control the formation of bimetallic heterogeneous nanocrystals is desirable for many applications in plasmonics and catalysis. In this work, we observe the synthesis and characterization of stable, monodisperse, and solution-processed Cu-Ag bimetallic nanoparticles with specific but unusual elemental arrangements that are consistent with a recently developed thermodynamic model. Using air-free scanning transmission electron microscopy with energy-dispersive X-ray spectroscopy, the distribution of Cu and Ag positions was unambiguously identified within individual nanocrystals (NCs), leading to the discovery of a Cu-Ag nanocrescent shape. A simple yet versatile thermodynamic model was applied to illustrate how the interplay between surface and interface energies determines the particle morphology. It is found that there exists a range of surface-to-interface energy ratios under which crescent-shaped nanocrystals are the thermodynamically favored products, with the morphology tunable by adjusting the Ag content. Moreover, we show the conversion of Cu-Ag nanocrescents into Ag@Cu 2 O upon mild oxidation, whereas fully core-shell Cu@Ag NCs are robust against oxidation up to 100 °C. The plasmonic and interband absorptions of Cu-Ag NCs depend on the composition and the degree of Cu oxidation, which may find application in light-driven catalysis.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Nonlinear Dynamics and Phase Space Manipulations of High-Brightness Beams

The project consisted of two main tasks. Each task had several specific aims. The three main objectives of Task 1 were: 1. Investigation of the flat beam technique to produce high transverse emittance ratio longitudinally-compressed bunches, 2. Exploration of a new chicane-like transverse-to-longitudinal phase space exchanger for precise pulse shaping and emittance exchange, 3. Applications of flat-beam with shaped current profile(s) to dielectric wakefield acceleration in an asymmetric waveguide. The outcome of our research was to performed details simulations of flat-beam generation and compression. Some preliminary experiment on flat-beam generation and compression were conducted at the FAST-IOTA injector in parallel to commissioning activities. Likewise, the longitudinal phase-space transformation was not fully explored; we participated in experiments conducted at the Argonne Wakefield Accelerator and especially introduced a simple transverse-shaping technique.

43 PARTICLE ACCELERATORS↗

Some characteristic features of the construction of the amplifying channel for working with semiconductor detectors in the charged particle energy spectrometer

A transistorized spectrometric amplifier with a shaper is reported that selects the shape of the frequency characteristic of the amplifying channel for which the primary frequency spectrum of the signal will pass, but where the noise spectrum is limited to the maximum. A procedure is presented for selecting the shaping circuits and their inclusion principles.

Kuzyuta, E. I.↗

Plasma-depleted holes, waves, and energized particles from high-altitude explosive plasma perturbation experiments

The results of high-explosive shaped charge experiments King Crab and Bubble Machines I and II, intended to perturb the ambient plasma and magnetic field, are discussed. The instrumentation was flown above an altitude of 460 km in March 1980 and 1981 and comprised a single-axis dipole electric field detector, a fixed bias cylindrical Langmuir probe, a three-axis attitude magnetometer, and curved plated energetic ion and electron electrostatic analyzer. Among the effects of the explosion which are detailed, emphasis is placed on the creation of an ion-depleted dark hole during the Bubble Machine II experiment; mechanisms explaining the phenomenon are outlined. The auroral intensity ion beams with energies of up to 6.8 keV, observed following the explosion in the field-aligned ion electrostatic analyzer, are suggested to represent an existing ion conic population pitch angle scattered by the released barium into the view of the detector.

Wescott, E. M.↗

Muon g-2 Experiment Shimming

The Muon g-2 experiment at Fermilab will use as its primary instrument a 52-foot-wide electromagnet that creates a precise magnetic field. In this video, Fermilab's Brendan Kiburg explains the lengthy process of finely "shimming" that magnetic field into shape.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Fallout melt debris and aerodynamically-shaped glasses in beach sands of Hiroshima Bay, Japan

An intricate association of millimeter-sized, aerodynamically-shaped debris, including glass spherules, glass filaments, and composite-fused melt particles was recovered from beach sands on the shores of the Motoujina Peninsula in Hiroshima Bay, Japan. Based on optical microscopy, this debris comprises six morphological groups ranging from clear glasses to rubber-like constituents. Scanning electron microscopy and synchrotron X-ray microdiffraction revealed dominant aluminum, silicon and calcium (Al-Si-Ca) elemental composition with some iron, mainly in glass, associated with precipitates of mullite and anorthite microcrystals, hematite dendrites and iron-chromium globules, indicative of original temperature conditions >1800 °C. Aerodynamically-shaped fallout debris, including glass spherules described in this study, are generally produced by single high-energy catastrophic events, such as an extraterrestrial body impacting Earth or a nuclear explosion. Our work interprets the large volumes of fallout debris generated under extreme temperature conditions as products of the Hiroshima August 6th, 1945 atomic bomb aerial detonation. The chemical composition of the melt debris provides clues to their origin, particularly with regard to city building materials. This study is the first published record and description of fallout resulting from the destruction of an urban environment by atomic bombing.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

On the upper bound of entropy production rate from particle multiplicity in heavy ion collisions

We provide a simple derivation for particle production in heavy-ion collisions that is proportional to the rate of entropy production. We find that the particle production depends only on the power of the centre-of-mass collision energy $\sqrt{s_{\rm NN}}$ and the effective phase-space/volume (e.g. geometry of the collision approximated by the number of nucleons participating in the collision $N_{\rm part}$). We show that at low-energies the pseudo-rapidity density of particles per participating nucleon pair scales linearly with $\sqrt{s_{\rm NN}}$ while at high-energies with $\sqrt{s_{\rm NN}}^{1/3}$. The $\sqrt{s_{\rm NN}}^{1/3}$ region is directly related to sub-nucleon degrees of freedom and creation of a quark-gluon plasma (QGP). This picture explains experimental observation that the shape of the distributions of pseudorapidity-density per nucleon pair of charged particles does not depend on $\sqrt{s_{\rm NN}}$ over a large span of collision energies. We provide an explanation of the scaling and connect it with the maximum rate per unit time of entropy production. We conclude with remarks on the hadron-parton phase transition. In particular, our considerations suggest that the pseudo-rapitidy density of the produced particles per $N_{\rm part}/2$ larger than approximately 1 (excluding particles from jet fragmentation) is a signature of a QGP formation.

Ploskon, Mateusz↗

Effects of asymmetry and hot-spot shape on ignition capsules

Asymmetric implosion of inertial confinement fusion capsules is known, both experimentally and computationally, to reduce thermonuclear performance. This work shows that low-mode asymmetries degrade performance as a result of a decrease in the hydrodynamic disassembly time of the hot-spot core, which scales with the minimum dimension of the hot spot. The asymmetric shape of a hot spot results in decreased temperatures and areal densities and allows more alpha particles to escape, relative to an ideal spherical implosion, thus reducing alpha-energy deposition in the hot spot. Here, we extend previous ignition theory to include the hot-spot shape and quantify the effects of implosion asymmetry on both the ignition criterion and the capsule performance. The ignition criterion becomes more stringent with increasing deformation of the hot spot. The new theoretical results are validated by comparison with existing experimental data obtained at the National Ignition Facility. The shape effects on thermonuclear performance are relatively more noticeable for capsules having self-heating and high yields. As a result, the degradation of thermonuclear burn can be as high as 45% for shots with a yield lower than 2 × 10 15 and less than 30% for shots with a higher yield.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Calculation of momentum distribution function of a non-thermal fermionic dark matter

The most widely studied scenario in dark matter phenomenology is the thermal WIMP scenario. Inspite of numerous efforts to detect WIMP, till now we have no direct evidence for it. A possible explanation for this non-observation of dark matter could be because of its very feeble interaction strength and hence, failing to thermalise with the rest of the cosmic soup. In other words, the dark matter might be of non-thermal origin where the relic density is obtained by the so-called freeze-in mechanism. Furthermore, if this non-thermal dark matter is itself produced substantially from the decay of another non-thermal mother particle, then their distribution functions may differ in both size and shape from the usual equilibrium distribution function. In this work, we have studied such a non-thermal (fermionic) dark matter scenario in the light of a new type of U(1){sub B−L} model. The U(1){sub B−L} model is interesting, since, besides being anomaly free, it can give rise to neutrino mass by Type II see-saw mechanism. Moreover, as we will show, it can accommodate a non-thermal fermionic dark matter as well. Starting from the collision terms, we have calculated the momentum distribution function for the dark matter by solving a coupled system of Boltzmann equations. We then used it to calculate the final relic abundance, as well as other relevant physical quantities. We have also compared our result with that obtained from solving the usual Boltzmann (or rate) equations directly in terms of comoving number density, Y . Our findings suggest that the latter approximation is valid only in cases where the system under study is close to equilibrium, and hence should be used with caution.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Novel Tube Design for Superheater Heat Exchanger Enabled Via Additive Manufacturing

Superheater tubes are critical boiler components that operate at relatively higher temperatures and pressure. Amongst the primary concerns for these tubes is the deposition of ash particles on the tube surface, leading to the reduced thickness of the tube due to material corrosion, consequently causing early creep failure of the component. In this research, a novel tube design has been proposed which resembles a teardrop or ogive shape to reduce the drag and concurrently improve the creep life of the superheater tubes. To administer the practicality of novel tubes, metal additive manufacturing (AM), for instance, laser-powder bed fusion (L-PBF), has been proposed. These unconventional designs were assessed and compared with the baseline circular tube design for mechanical design requirements (hoop stress and creep life) and the particle and flue gas flow characteristics around the differently shaped tubes. A thermomechanical finite element (FE) analysis was performed for hoop stress calculations. This study also emphasizes on effect of circumferential thermal variation on hoop stress distribution in tubes. Therefore, a detailed two-dimensional (2D) thermal simulation has been performed to report the circumferential thermal variation on the tube. A computational fluid dynamics (CFD) analysis coupled with particle tracing was performed for gas flow visualization and particle tracing around the proposed shapes and baseline circular-shaped tube design. The Schlieren optic setup was built and leveraged for qualitative validation of the proposed design. The complete design methodology established in the paper shows teardrop-shaped tubes better in terms of drag and creep life in contrast to the circular-shaped tube.

42 ENGINEERING↗

Test Plan for the Reirradiation Heating Test of Fuel Particles from AGR 2 Compact 5-4-2

Post irradiation examination (PIE) and high-temperature heating tests of tristructural isotropic (TRISO)-coated fuel particles and compacts from the second Advanced Gas Reactor (AGR) irradiation experiment, AGR 2, are in progress. This test plan describes the reirradiation and subsequent high-temperature testing of loose fuel particles obtained from AGR 2 Compact 5-4-2. To simulate exposed kernels, four of these particles have been cracked at Oak Ridge National Laboratory (ORNL) to produce localized defects that extend through the TRISO layers (outer-pyrolytic carbon [OPyC], silicon carbide [SiC], and inner-pyrolytic carbon [IPyC]) while keeping these layers in-place and maintaining the shape and integrity of the kernel. To generate short-lived fission products, these particles will be reirradiated in the Neutron Radiography (NRAD) reactor prior to heating testing in the Fuel Accident Condition Simulator (FACS) furnace. FACS testing will be at 1600°C, and fission products released from the reirradiated particles will be measured. The intention of the test is to assess the retention of short-lived fission products I-131 (t1/2 = 8.02 days) and Xe-133 (t1/2 = 5.2 days) in the fuel kernels at accident temperatures.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Revisiting the Hail Radar Reflectivity–Kinetic Energy Flux Relation by Combining T-Matrix and Discrete Dipole Approximation Calculations to Size Distribution Observations

The retrieval of hail kinetic energy with weather radars or its simulation in numerical models is challenging because of the shape complexity and variable density of hailstones. We combine 3D scans of individual hailstones with measurements of the particle size distributions (PSD) and T-matrix calculations to understand how hail reflectivity Z changes when approximating hailstones as spheroids, as compared to the realistic shapes obtained by 3D scanning technology. Additionally, recent terminal velocity relations are used to compare Z to the hail kinetic energy flux E ˙ . We parameterize the hail backscattering cross sections at L, S, C, and X bands as a function of size between 0.5 and 5.0 cm, matching the range of the observed PSDs. The scattering calculations use the T-matrix method for size parameters below 1.0 and the discrete dipole approximation (DDA) method otherwise. The DDA calculations are done for 48 digital models of realistic hailstones of sizes between 1 and 5 cm. The DDA cross sections are calculated for multiple orientations and averaged assuming a fully random orientation distribution to provide a single value per hailstone. The T-matrix reflectivity assuming solid ice spheres presents negligible differences to DDA results for size parameters below 1.0. Therefore, T matrix was used to fill in the gaps left by the DDA calculations. The results are mapped to the same size bins of the observed PSDs, allowing the calculation of the radar reflectivity. This is then correlated to E ˙ , allowing a potential improvement of past retrieval methods of E ˙ from Z in multiple wavelengths.

54 ENVIRONMENTAL SCIENCES↗

Experimental Observation of Inertial Particles through Idealized Hydroturbine Distributor Geometry

To increase and maintain existing hydropower capacity within biological performance-based regulations, predictive simulation methods are needed that can reliably estimate the risk to fish passing through flow passage routes at hydropower facilities. One of the central challenges is to validate the software capabilities for simulating the trajectories, including collisions, of inertial particles against laboratory data. In this work, neutrally buoyant spherical- and rod-shaped beads were released upstream of laboratory-scale geometries representative of the distributor of a hydroturbine. The experimental campaign involved a test matrix of 24 configurations with variations in bead geometry, collision target geometry, flow speeds, and release locations. A total of more than 10,000 beads were recorded using high-speed video cameras and analyzed using particle tracking software. Collision rates from 1–7% were observed for the cylinder geometry and rates of 1–23% were observed for the vane array over the range of test configurations.

13 HYDRO ENERGY↗

Microstructural effects in the simulation of creep of concrete

The influence of the microstructure on the visco-elastic properties of concrete is investigated using finite element simulations at the meso-scale. We first derive a constitutive law for the creep of the cement paste which accounts for both recoverable and permanent deformations, as well as the influence of temperature and internal relative humidity. The model is calibrated on a set of experiments at the cement paste scale, and then validated after upscaling to the concrete scale. The model is then applied to study the influence of the microstructure on the macroscopic creep of concrete. We show that materials with finer particles exhibit less creep, and that the anisotropy of creep can be explained with the shape and orientation of the aggregates. Furthermore, the acceleration of the stress relaxation in the presence of damage is explained by the micro-mechanical interaction between the aggregates, the cement paste, and the micro-cracks.

36 MATERIALS SCIENCE↗