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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 127 records · Page 7

Development of Discharge in a Saline Solution at Near-Threshold Voltages

The development of a discharge in a point−plane gap filled with a saline solution with a salt content of 3% was studied experimentally. The duration of the voltage pulse applied to the gap was about 2 ms. Data are presented on the formation dynamics of gas microcavities at near-threshold voltages at which gas-discharge plasma appears in some microcavities. The cavities are conglomerates of microbubbles with a typical size of ≈100 μm. At the threshold voltage (≈750 V), the active electrode is covered with a gas layer and the gap voltage is in fact applied to this layer, which leads to the development of discharges in individual microbubbles. In this case, the discharge operates in the form of short current pulses. The number of microcavities filled with plasma increases as the voltage grows above the threshold value. At the plasma boundary, new microbubbles are formed, in which discharges are ignited. As a result, the plasma front propagates from the active electrode into the gap with a characteristic velocity of 10{sup 3} cm/s.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Corresponding Orbitals Derived from Periodic Bloch States for Electron Transfer Calculations of Transition Metal Oxides

An approach for modeling electron transfer in solids and at surfaces of iron - (oxy- hydr)oxides and other redox active solids has been developed for electronic structure methods (i.e., plane-wave DFT) capable of performing ab initio molecular dynamics eciently with periodic cells and large system sizes while at the same time being accurate enough to be used in the estimation of the electron-transfer coupling matrix element, VAB, and the electron transfer transmission factor, el. This method is an extension of the valence bond theory ET method for molecules and clusters, imple- mented by Dupuis and co-workers and used extensively by Rosso and co-workers, in which scaled corresponding orbitals derived from the Bloch states are used to calculate the o-diagonal matrix elements HAB and SAB. A key development of the present work is the formulation of algorithms to improve of the accuracy of integration of the exact exchange integral in periodic boundary conditions. This method is demonstrated on model systems for electron small polaron transfer in iron-(oxyhydr)oxides, including bare Fe2+{Fe3+ ions, and in [Fe3+(OH2)2(OH)2)]n+ n chains representing the common edge-sharing Fe octahedral motif in these materials.

Bylaska, Eric J.↗

Scattering of radio frequency waves by cylindrical density filaments in tokamak plasmas

In tokamak fusion plasmas, coherent fluctuations in the form of blobs or filaments are routinely observed in the scrape-off layer. Radio frequency (RF) electromagnetic waves, excited by antenna structures placed near the wall of a tokamak, have to propagate through the scrape-off layer before reaching the core of the plasma. While the effect of fluctuations on the properties of RF waves has not been quantified experimentally, it is of interest to carry out a theoretical study to determine if fluctuations can affect the propagation characteristics of RF waves. Usually, the difference between the plasma density inside the filament and the background plasma density is sizable, the ratio of the density difference to the background density being of order one. Generally, this precludes the use of geometrical optics in determining the effect of fluctuations, since the relevant ratio has to be much less than one, typically, of the order of 10% or less. In this study, a full-wave, analytical model is developed for the scattering of a RF plane wave by a cylindrical plasma filament. It is assumed that the plasma inside and outside the filament is cold and uniform and that the major axis of the filament is aligned along the toroidal magnetic field. The ratio of the density inside the filament to the density of the background plasma is not restricted. The theoretical framework applies to the scattering of any cold plasma wave. In order to satisfy the boundary conditions at the interface between the filament and the background plasma, the electromagnetic fields inside and outside the filament need to have the same k ∥ , the wave vector parallel to the ambient magnetic field, as the incident plane wave. Consequently, in contrast to the scattering of a RF wave by a spherical blob [Ram et al., Phys. Plasmas 20, 056110-1–056110-10 (2013)], the scattering by a field-aligned filament does not broaden the k ∥ spectrum. However, the filament induces side-scattering leading to surface waves and can also couple some power to the cold plasma wave different from the incident wave. The changes induced by a filament in the propagation of electron cyclotron waves and lower hybrid waves are illustrated by numerical results displaying the properties of the Poynting vector. The Poynting flux in the wake of the filament, and directed towards the core of the plasma, develops a spatial structure due to diffraction and shadowing. Finally and thus, the fluctuations affect the uniformity of power flow into the plasma.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Aquantis C-Plane Ocean Current Turbine Project

The Aquantis 2.5 MW Ocean Current Generation Device technology developed by Dehlsen Associates, LLC (DA) is a derivation of wind power generating technology (a means of harnessing a slow moving fluid) adapted to the ocean environment. The Aquantis Project provides an opportunity for accelerated technological development and early commercialization, since it involves the joining of two mature disciplines: ocean engineering and wind turbine design. The Aquantis Current Plane (C-Plane) technology is an ocean current turbine designed to extract kinetic energy from a current flow. The technology is capable of achieving competitively priced, continuous, base-load, and reliable power generation from a source of renewable energy not before possible in this scale or form.

16 TIDAL AND WAVE POWER↗

A proper assessment of TEM diffraction patterns originating from CrN nitrides in a ferritic matrix

Highlights: • A proper assessment of TEM diffraction pattern along the [001]{sub α-Fe} of a nitrided Fe-Cr alloy is proposed • Diffraction pattern results from the diffraction of the ferritic matrix and the three nitrides variants • Thin foil’s thickness plays a key role in the obtained diffraction pattern • Relrods located in the first layer of the reciprocal lattice can provide extra reflections in the diffraction patterns - Abstract: Upon nitriding of a Fe-3%Cr alloy at 550 °C during 48 h at a nitriding potential K{sub N} = 5 atm{sup −1/2}, finely dispersed CrN grains precipitate. Considering that the nitrides developing within the nitrided layer adopt a cubic, rock-salt structure, Transmission Electron Microscopy (TEM) investigations revealed the Bain orientation relationships (also called Baker-Nutting) existing between the matrix and the precipitates. Given the latter and the structures of both ferrite (bcc) and nitrides (fcc), we have shown that group theory predicts the existence of three nitrides variants, orthogonal to each other, developing in ferrite along the <001>{sub α-Fe} directions, which is in agreement with our experimental observations. The nitrides adopt a very thin platelet-like morphology, energetically corresponding to an absolute extremum. Diffraction patterns obtained along the [001]{sub α-Fe} result from the simultaneous diffraction of the ferritic matrix and the three nitrides variants. The platelet-like nitride precipitates give birth to diffuse intensity lines, originating from the two families developing along the (100) and (010) ferrite planes, as well as possible appearance of additional reflections, located at the forbidden positions {100}{sub α-Fe} and {110}{sub CrN} of the remaining variant, driving the interpretation of such diffraction patterns complicated. Foil thickness has proven to play a key role in the occurrence of this phenomenon. When the geometric diffraction conditions are favorable (i.e. very thin foil along the zone axis and very fine precipitates platelets), TEM analysis permitted to attribute these extra reflections to the nodes located in the first layer of the third variant's reciprocal space.

36 MATERIALS SCIENCE↗

The crystal facet-dependent electrochemical performance of TiO 2 nanocrystals for heavy metal detection: Theoretical prediction and experimental proof

Tailored design/fabrication of electroanalytical materials with highly-active exposed crystal planes is of great importance for the development of electrochemical sensing. In this work, combining experimental and theoretical efforts, we reported a facile strategy to fabricate TiO 2 nanocrystals with tunable electrochemical performance for heavy metal detection. Density functional theory (DFT) calculations indicated that TiO 2 (001) facet showed relative larger adsorption energy and lower diffusion energy barrier toward heavy metal ions, which is favorable for obtaining better electrochemical stripping behaviors. Based on this prediction, a series of TiO 2 nanocrystals with different ratios of exposed (001) and (101) facets were synthesized. Electrochemical stripping experiments further demonstrated that with the increase of the percentage of exposed (001) facet, the sensitivity toward Pb(II) and Cd(II) was increased accordingly. When the percentage of exposed (001) facet was increased from 7% to 80%, the sensitivity increased by 190% and 93% for Pb(II) and Cd(II), respectively. In conclusion, our work provides an effective route to construct advanced electroanalytical materials for sensing.

47 OTHER INSTRUMENTATION↗

Beyond the ponderomotive limit: Direct laser acceleration of relativistic electrons in sub-critical plasmas

We examine a regime in which a linearly polarized laser pulse with relativistic intensity irradiates a sub-critical plasma for much longer than the characteristic electron response time. A steady-state channel is formed in the plasma in this case with quasi-static transverse and longitudinal electric fields. These relatively weak fields significantly alter the electron dynamics. The longitudinal electric field reduces the longitudinal dephasing between the electron and the wave, leading to an enhancement of the electron energy gain from the pulse. The energy gain in this regime is ultimately limited by the superluminosity of the wave fronts induced by the plasma in the channel. The transverse electric field alters the oscillations of the transverse electron velocity, allowing it to remain anti-parallel to laser electric field and leading to a significant energy gain. The energy enhancement is accompanied by the development of significant oscillations perpendicular to the plane of the driven motion, making trajectories of energetic electrons three-dimensional. Proper electron injection into the laser beam can further boost the electron energy gain.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Optical investigation of effective permeability of dilute magnetic dielectrics with magnetic field

The prime objective of this paper is to investigate the magnetic nature of dilute magnetic dielectrics (DMD) under variation of external magnetic field. The said variation is studied over developed nano-sized Gadolinium Oxide as a DMD system. The observed experimental field variation of the effective magnetic permeability is analyzed results of optical experiment. The experiment records the variation of Brewster angle of incident polarized LASER beam from the surface of developed DMD specimen with applied out of plane external magnetic field. The effective refractive index and hence relative magnetic permeability were estimated following electro-magnetic theory. The overall results obtained and agreement between theory and experiment are good.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Theoretical analysis of the extraction of neutron skin thickness from coherent π 0 photoproduction off nuclei

Background: Coherent π⁢ 0 photoproduction on heavy nuclei has been suggested as a reliable tool to infer neutron skin thicknesses. To this aim, various experiments have been performed, especially on 208 Pb. Purpose: Here, we analyze the sensitivity of that reaction process to the nucleonic density, and especially to the neutron skin thickness, for 12 C, 40 Ca, and 208 Pb, for which reliable data exist, and on 116,124 Sn, for which measurements have been performed in Mainz. We study also the role played by the π 0 -nucleus final-state interaction. Methods: A model of the reaction is developed at the impulse approximation considering either plane waves or distorted waves to describe the π 0 -nucleus scattering in the outgoing channel. Results: Our calculations are in good agreement with existing data, especially for 208 Pb. The sensitivity of the theoretical cross sections to the choice of the nucleonic density is small and below the experimental resolution. Conclusions: Coherent π 0 photoproduction is mostly an isoscalar observable that bares no practical sensitivity to the neutron skin thickness. To infer that structure observable it should be coupled to other reaction measurements, such as electron scattering, or by comparing experiments performed on isotopes of the same chemical element.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Establishing the World Reference for Measuring the Atmospheric Longwave Irradiance with Traceability to the International System of Units

Advancing climate change research requires accurate and traceable measurement of the atmospheric longwave irradiance. Current measurement capabilities are limited to an estimated uncertainty of larger than +/- 6 W/ m2 using the interim World Infrared Standard Group (WISG). Two independently designed and calibrated absolute radiometers measuring downwelling longwave irradiance were compared during five outdoor comparisons in 2013, 2015, and 2017 at the Physikalisch Meteorologisches Observatorium Davos/World Radiation Center (PMOD/WRC) and the USA-DOE Atmospheric Radiation Measurement program (ARM) in the Southern Great Planes (SGP). Two Absolute Cavity Pyrgeometers (ACPs) developed by the National Renewable Energy Laboratory (NREL) and four Integrating Sphere Infrared Radiometers (IRISs) developed by PMOD/WRC took part in these intercomparisons. From five comparisons, the difference between the irradiance measured by the ACPs and IRISs varied from 0.2 W/ m2 to 2.5 W/ m2 based on the atmospheric conditions, which is within the combined stated uncertainties of +/-3 W/ m2. The irradiance measured by the WISG is lower than the average irradiance measured by ACPs and IRISs, magnitude of the difference varied from 0.2 W/m2 to 6.6 W/ m2 depending on the integrated water vapor. A concerted effort at the World Meteorological Organization (WMO) Commission for Instruments and Methods of Observation Commission (CIMO) Task Team on Radiation References (TT) started during a meeting from November 15 to 17, 2017 in the National Physical Laboratory (NPL), Teddington, United Kingdom to establish a world reference for measuring the atmospheric longwave irradiance with lower uncertainty and with traceability to SI units by using the ACPs and IRISs as the reference.

14 SOLAR ENERGY↗

Establishing the World Reference for Measuring the Atmospheric Longwave Irradiance with Traceability to the International System of Units

Advancing climate change research requires accurate and traceable measurement of atmospheric longwave irradiance. Measurement capabilities are limited to an estimated uncertainty of larger than +/- 6 W/m2 using the interim World Infrared Standard Group (WISG). Two independently designed and calibrated absolute radiometers measuring downwelling longwave irradiance were compared during five outdoor comparisons in 2013, 2015, and 2017 at the Physikalisch Meteorologisches Observatorium Davos World Radiation Center (PMOD/WRC) and the U.S. Department of Energy (DOE) Atmospheric Radiation Measurement program (ARM) in the Southern Great Planes (SGP). Two Absolute Cavity Pyrgeometers (ACPs) developed by the National Renewable Energy Laboratory (NREL) and four Integrating Sphere Infrared Radiometers (IRISs) developed by PMOD/WRC took part in these intercomparisons.From the five comparisons, the difference between the irradiance measured by ACPs and IRISs varied from 0.2 W/m2 to 2.5 W/m2 based on atmospheric conditions, which is within the combined stated uncertainties of +/- 3 W/m2. The irradiance measured by the WISG is lower than the average irradiance measured by ACPs and IRISs. The magnitude of difference varied from 0.2 W/m2 to 6.6 W/m2 depending on the integrated water vapor. A concerted effort to establish a world reference for measuring the atmospheric longwave irradiance with lower uncertainty and with traceability to the International System of Units (SI) by using the ACPs and IRISs as the reference started at the World Meteorological Organization (WMO). The Commission for Instruments and Methods of Observation Commission (CIMO) Task Team on Radiation References (TT) meeting was held in 2017 at the National Physical Laboratory (NPL), in Teddington, United Kingdom to discuss specific recommendation on the traceability of the atmospheric longwave irradiance to the International System of units (SI).

14 SOLAR ENERGY↗

Comparison of on-shot, in-tank, and equivalent-target-plane measurements of the OMEGA Laser System focal spot

The newly developed full-beam-in-tank (FBIT) diagnostic has the capability to characterize multiple beamlines in the target chamber. In addition to measuring multiple beams, we can obtain measurements of the step-by-step changes to achieve smoothing by spectral dispersion (SSD), the SSD kernel, and SSD synchronization. Since other existing diagnostics are all located upstream of the target chamber, this diagnostic can be used to explore a propagating beam through the final optics assembly. In this work, we investigate current discrepancies between laser diagnostics and experimental results by comparing results of on-shot direct measurements using FBIT and the equivalent-target-plane diagnostic.

47 OTHER INSTRUMENTATION↗

Cutting planes for the multistage stochastic unit commitment problem

As renewable energy penetration rates continue to increase in power systems worldwide, new challenges arise for system operators in both regulated and deregulated electricity markets to solve the security-constrained coal-fired unit commitment problem with intermittent generation (due to renewables) and uncertain load, in order to ensure system reliability and maintain cost effectiveness. In this paper, we study a security-constrained coal-fired stochastic unit commitment model, which we use to enhance the reliability unit commitment process for day-ahead power system operations. In our approach, we first develop a deterministic equivalent formulation for the problem, which leads to a large-scale mixed-integer linear program. Then, we verify that the turn on/off inequalities provide a convex hull representation of the minimum-up/down time polytope under the stochastic setting. Next, we develop several families of strong valid inequalities mainly through lifting schemes. In particular, by exploring sequence independent lifting and subadditive approximation lifting properties for the lifting schemes, we obtain strong valid inequalities for the ramping and general load balance polytopes. Lastly, branch-and-cut algorithms are developed to employ these valid inequalities as cutting planes to solve the problem. Our computational results verify the effectiveness of the proposed approach.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Improvement of the 2D/1D Method in MPACT Using the Sub-Plane Scheme

Oak Ridge National Laboratory and the University of Michigan are jointly developing the MPACTcode to be the primary neutron transport code for the Virtual Environment for Reactor Applications (VERA). To solve the transport equation, MPACT uses the 2D/1D method, which decomposes the problem into a stack of 2D planes that are then coupled with a 1D axial calculation. MPACT uses the Method of Characteristics for the 2D transport calculations and P3 for the 1D axial calculations, then accelerates the solution using the 3D Coarse mesh Finite Dierence (CMFD) method. Increasing the number of 2D MOC planes will increase the accuracy of the alculation, but will increase the computational burden of the calculations and can cause slow convergence or instability. To prevent these problems while maintaining accuracy, the sub-plane scheme has been implemented in MPACT. This method sub-divides the MOC planes into sub-planes, refining the 1D P3 and 3D CMFD calculations without increasing the number of 2D MOC planes. To test the sub-plane scheme, three of the VERA Progression Problems were selected: Problem 3, a single assembly problem; Problem 4, a 3x3 assembly problem with control rods and pyrex burnable poisons; and Problem 5, a quarter core problem. These three problems demonstrated that the sub-plane scheme can accurately produce intra-plane axial flux profiles that preserve the accuracy of the fine mesh solution. The eigenvalue dierences are negligibly small, and dierences in 3D power distributions are less than 0.1% for realistic axial meshes. Furthermore, the convergence behavior with the sub-plane scheme compares favorably with the conventional 2D/1D method, and the computational expense is decreased for all calculations due to the reduction in expensive MOC calculations.

Graham, Aaron M↗

Iterative diagonalization of the non-Hermitian transcorrelated Hamiltonian using a plane-wave basis set: Application to sp-electron systems with deep core states

We develop an iterative diagonalization scheme in solving a one-body self-consistent-field equation in the transcorrelated (TC) method using a plane-wave basis set. Non-Hermiticity in the TC method is well handled with a block-Davidson algorithm. We verify that the required computational cost is efficiently reduced by our algorithm. In addition, we apply our plane-wave-basis TC calculation to some simple sp-electron systems with deep core states to elucidate an impact of the pseudopotential approximation to the calculated band structures. We find that a position of the deep valence bands is improved by an explicit inclusion of core states, but an overall band structure is consistent with a regular setup that includes core states into the pseudopotentials. This study offers an important understanding for the future application of the TC method to strongly correlated solids.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

3D magnetic imaging using electron vortex beam microscopy

Abstract Electron vortex beams are free-electron waves that carry orbital angular momentum. There has been growing theoretical and experimental interest in the use of electron vortex beams as a tool for the investigation of magnetic materials. However, due to the complex wavefront of the propagating waves, a deeper understanding of the interaction of electron vortex beams and the magnetic sample is needed. Here we calculate the magnetic phase shift that an electron vortex beam obtains upon transmitting through a magnetic sample. We show that this magnetic phase shift is influenced by the out-of-plane magnetization, which is a unique characteristic of incident electron vortex beams and is proportional to their orbital angular momentum. Finally, we develop a phase retrieval methodology to retrieve the out-of-plane component of magnetization. Based on our theory, we discuss suitable experimental conditions that would enable this imaging capability for magnetic materials and further extend to non-magnetic chiral materials.

47 OTHER INSTRUMENTATION↗

Concatenated analyses of phase space microbunching in high brightness electron beam transport

Microbunching instability (MBI) has been a challenging issue in high-brightness electron beam transport for modern accelerators. The existing theoretical formulation of MBI for recirculating accelerators is based on the single-pass analysis. For multi-pass recirculation or a long beam transport line, the intuitive way of quantifying MBI by successive multiplication of individual scalar amplification gains from subsections of a beamline was found to underestimate the effect. More thorough analyses based on concatenation of gain matrices, aimed to combine the density, energy, and transverse–longitudinal modulations for a general linear transport line, will be developed in this paper. Inclusion of such cross-plane microbunching structures in semi-analytical Vlasov analysis is a crucial step to systematically characterize phase space modulations for a beamline complex in terms of concatenating individual beamline segments. In this paper we outline the concept of gain matrix and develop a semi-analytical formulation to include the microbunching structures in the aforementioned phase space modulations. Moreover we investigate the phase space microbunching dynamics in an example lattice of the recirculating beamline, compare the semi-analytical calculation with particle tracking simulations, and find that the microbunching amplification calculated from multiplication of concatenated gain matrices can be considered as upper limit to the start-to-end gains.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Evaluation of scenario-specific modeling approaches to predict plane of array solar irradiation

The two main objectives of this study are to evaluate the extent to which the prediction of plane of array irradiance is improved when diffuse radiation is predicted using location-specific regression models developed from onsite measured data as against using generalized models and to estimate the expected uncertainties associated with plane of array irradiance predictions under different data collection scenarios likely to be encountered in practical situations.

Moslehi, Salim↗