Erratum: “Reduced model prediction of electron temperature profiles in microtearing-dominated National Spherical Torus eXperiment plasmas” [Phys. Plasmas 21, 082510 (2014)]
No abstract prepared.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
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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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New XDM-corrected potential energy surfaces for Ar–NO(X{sup 2}Π): A comparison with CCSD(T) calculations and experiments
We report new potential energy surfaces for the ground state Ar–NO(X{sup 2}Π) van der Waals system calculated using the unrestricted Hartree-Fock (UHF) method with the addition of the Becke-Roussel correlation functional and exchange-hole dipole moment dispersion correction (XDM). We compare UHFBR-XDM surfaces and those previously reported by Alexander from coupled cluster CCSD(T) calculations [J. Chem. Phys. 111, 7426 (1999)]. The bound states of Ar–NO have been investigated with these new UHFBR-XDM surfaces, including relative energy-level spacing, adiabatic bender states and wave functions, and spectroscopic data. These results have been found to be in good agreement with calculations based on the CCSD(T) PESs. These new PESs are used to investigate the inelastic scattering of NO(X) by Ar. Full close-coupling integral cross sections at collision energies of 442 cm{sup −1}, 1774 cm{sup −1} and differential cross sections at collision energy of 530 cm{sup −1} were determined for transitions out of the lowest NO(X) rotational level (j = ω = 1/2,f). These cross sections are in good agreement with those calculated with CCSD(T) and accordingly in good agreement with the most recent initial and final state resolved experimental data. The UHFBR-XDM scheme yields high-quality potential surfaces with computational cost comparable to the Hartree-Fock method and our results may serve as a benchmark for application of this scheme to collisions between larger molecules.
74 ATOMIC AND MOLECULAR PHYSICS↗
Simulation of injector dynamics during steady inductive helicity injection current drive in the HIT-SI experiment
We present simulations of inductive helicity injection in the Helicity Injected Torus with Steady Inductive helicity injection (HIT-SI) device that treats the entire plasma volume in a single dynamic MHD model. A new fully 3D numerical tool, the PSI-center TETrahedral mesh code, was developed that provides the geometric flexibility required for this investigation. Implementation of a zero-β Hall MHD model using PSI-TET will be presented including formulation of a new self-consistent magnetic boundary condition for the wall of the HIT-SI device. Results from simulations of HIT-SI are presented focusing on injector dynamics that are investigated numerically for the first time. Asymmetries in the plasma loading between the two helicity injectors and progression of field reversal in each injector are observed. Analysis indicates cross-coupling between injectors through confinement volume structures. Injector impedance is found to scale with toroidal current at fixed density, consistent with experimental observation. Comparison to experimental data with an injector drive frequency of 14.5 kHz shows good agreement with magnetic diagnostics. Global mode structures from Bi-Orthogonal decomposition agree well with experimental data for the first four modes.
71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
Magnetohydrodynamic turbulence: Observation and experiment
We provide a tutorial on the paradigms and tools of magnetohydrodynamic (MHD) turbulence. The principal paradigm is that of a turbulent cascade from large scales to small, resulting in power law behavior for the frequency power spectrum for magnetic fluctuations E{sub B}(f). We will describe five useful statistical tools for MHD turbulence in the time domain: the temporal autocorrelation function, the frequency power spectrum, the probability distribution function of temporal increments, the temporal structure function, and the permutation entropy. Each of these tools will be illustrated with an example taken from MHD fluctuations in the solar wind. A single dataset from the Wind satellite will be used to illustrate all five temporal statistical tools.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
The study of the transition regime between slab and mixed slab-toroidal electron temperature gradient modes in a basic experiment
Electron temperature gradient (ETG) modes are suspected sources of anomalous electron thermal transport in magnetically confined plasmas as in tokamaks. Prior work in the Columbia Linear Machine (CLM) has been able to produce and identify slab ETG modes in a slab geometry [Wei et al., Phys. Plasmas 17, 042108 (2010)]. Now by modifying CLM to introduce curvature to the confining axial magnetic field, we have excited mixed slab-toroidal modes. Linear theory predicts a transition between slab and toroidal ETG modes when (k{sub ∥}R{sub c})/(k{sub y}ρ) ∼1 [J. Kim and W. Horton, Phys. Fluids B 3, 1167 (1991)]. We observe changes in the mode amplitude for levels of curvature R{sub c}{sup −1}≪(k{sub ∥,slab})/(k{sub ⊥}ρ) , which may be explained by reductions in k{sub ∥} in the transition from slab to mixed slab-toroidal modes, as also predicted by theory. We present mode amplitude scaling as a function of magnetic field curvature. Over the range of curvature available in CLM experimentally we find a modest increase in saturated ETG potential fluctuations (∼1.5×), and a substantial increase in the power density of individual mode peaks (∼4–5×)
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
A fast rise-rate, adjustable-mass-bit gas puff valve for energetic pulsed plasma experiments
Not Available
Loebner, Keith T. K.↗
The effect of nearly steady shock waves in ramp compression experiments
Abstract not provided
71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
The laser micro-machining system for diamond anvil cell experiments and general precision machining applications at the High Pressure Collaborative Access Team
We report we have designed and constructed a new system for micro-machining parts and sample assemblies used for diamond anvil cells and general user operations at the High Pressure Collaborative Access Team, sector 16 of the Advanced Photon Source. The new micro-machining system uses a pulsed laser of 400 ps pulse duration, ablating various materials without thermal melting, thus leaving a clean edge. With optics designed for a tight focus, the system can machine holes any size larger than 3 μm in diameter. Unlike a standard electrical discharge machining drill, the new laser system allows micro-machining of non-conductive materials such as: amorphous boron and silicon carbide gaskets, diamond, oxides, and other materials including organic materials such as polyimide films (i.e., Kapton). An important feature of the new system is the use of gas-tight or gas-flow environmental chambers which allow the laser micro-machining to be done in a controlled (e.g., inert gas) atmosphere to prevent oxidation and other chemical reactions in air sensitive materials. The gas-tight workpiece enclosure is also useful for machining materials with known health risks (e.g., beryllium). Specialized control software with a graphical interface enables micro-machining of custom 2D and 3D shapes. The laser-machining system was designed in a Class 1 laser enclosure, i.e., it includes laser safety interlocks and computer controls and allows for routine operation. Though initially designed mainly for machining of the diamond anvil cell gaskets, the laser-machining system has since found many other micro-machining applications, several of which are presented here.
47 OTHER INSTRUMENTATION↗
Midplane neutral density profiles in the National Spherical Torus Experiment
Atomic and molecular density data in the outer midplane of NSTX [Ono et al., Nucl. Fusion 40, 557 (2000)] are inferred from tangential camera data via a forward modeling procedure using the DEGAS 2 Monte Carlo neutral transport code. The observed Balmer-β light emission data from 17 shots during the 2010 NSTX campaign display no obvious trends with discharge parameters such as the divertor Balmer-α emission level or edge deuterium ion density. Simulations of 12 time slices in 7 of these discharges produce molecular densities near the vacuum vessel wall of 2–8 × 10{sup 17 }m{sup −3} and atomic densities ranging from 1 to 7 × 10{sup 16 }m{sup −3}; neither has a clear correlation with other parameters. Validation of the technique, begun in an earlier publication, is continued with an assessment of the sensitivity of the simulated camera image and neutral densities to uncertainties in the data input to the model. The simulated camera image is sensitive to the plasma profiles and virtually nothing else. The neutral densities at the vessel wall depend most strongly on the spatial distribution of the source; simulations with a localized neutral source yield densities within a factor of two of the baseline, uniform source, case. The uncertainties in the neutral densities associated with other model inputs and assumptions are ≤50%.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
Integrated modeling of cryogenic layered highfoot experiments at the NIF
Integrated radiation hydrodynamic modeling in two dimensions, including the hohlraum and capsule, of layered cryogenic HighFoot Deuterium-Tritium (DT) implosions on the NIF successfully predicts important data trends. The model consists of a semi-empirical fit to low mode asymmetries and radiation drive multipliers to match shock trajectories, one dimensional inflight radiography, and time of peak neutron production. Application of the model across the HighFoot shot series, over a range of powers, laser energies, laser wavelengths, and target thicknesses predicts the neutron yield to within a factor of two for most shots. The Deuterium-Deuterium ion temperatures and the DT down scattered ratios, ratio of (10–12)/(13–15) MeV neutrons, roughly agree with data at peak fuel velocities <340 km/s and deviate at higher peak velocities, potentially due to flows and neutron scattering differences stemming from 3D or capsule support tent effects. These calculations show a significant amount alpha heating, 1–2.5× for shots where the experimental yield is within a factor of two, which has been achieved by increasing the fuel kinetic energy. This level of alpha heating is consistent with a dynamic hot spot model that is matched to experimental data and as determined from scaling of the yield with peak fuel velocity. Lastly, these calculations also show that low mode asymmetries become more important as the fuel velocity is increased, and that improving these low mode asymmetries can result in an increase in the yield by a factor of several.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
Understanding nucleic acid structural changes by comparing wide-angle x-ray scattering (WAXS) experiments to molecular dynamics simulations
Wide-angle x-ray scattering (WAXS) is emerging as a powerful tool for increasing the resolution of solution structure measurements of biomolecules. Compared to its better known complement, small angle x-ray scattering (SAXS), WAXS targets higher scattering angles and can enhance structural studies of molecules by accessing finer details of solution structures. Although the extension from SAXS to WAXS is easy to implement experimentally, the computational tools required to fully harness the power of WAXS are still under development. Currently, WAXS is employed to study structural changes and ligand binding in proteins; however, the methods are not as fully developed for nucleic acids. Here, we show how WAXS can qualitatively characterize nucleic acid structures as well as the small but significant structural changes driven by the addition of multivalent ions. We show the potential of WAXS to test all-atom molecular dynamics (MD) simulations and to provide insight into understanding how the trivalent ion cobalt(III) hexammine (CoHex) affects the structure of RNA and DNA helices. We find that MD simulations capture the RNA structural change that occurs due to addition of CoHex.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Combining experiment and optical simulation in coherent X-ray nanobeam characterization of Si/SiGe semiconductor heterostructures
The highly coherent and tightly focused x-ray beams produced by hard x-ray light sources enable the nanoscale characterization of the structure of electronic materials but are accompanied by significant challenges in the interpretation of diffraction and scattering patterns. X-ray nanobeams exhibit optical coherence combined with a large angular divergence introduced by the x-ray focusing optics. The scattering of nanofocused x-ray beams from intricate semiconductor heterostructures produces a complex distribution of scattered intensity. We report here an extension of coherent x-ray optical simulations of convergent x-ray beam diffraction patterns to arbitrary x-ray incident angles to allow the nanobeam diffraction patterns of complex heterostructures to be simulated faithfully. These methods are used to extract the misorientation of lattice planes and the strain of individual layers from synchrotron x-ray nanobeam diffraction patterns of Si/SiGe heterostructures relevant to applications in quantum electronic devices. The systematic interpretation of nanobeam diffraction patterns from semiconductor heterostructures presents a new opportunity in characterizing and ultimately designing electronic materials.
71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
Phonocatalysis. An ab initio simulation experiment
Using simulations, we postulate and show that heterocatalysis on large-bandgap semiconductors can be controlled by substrate phonons, i.e., phonocatalysis. With ab initio calculations, including molecular dynamic simulations, the chemisorbed dissociation of XeF{sub 6} on h-BN surface leads to formation of XeF{sub 4} and two surface F/h-BN bonds. The reaction pathway and energies are evaluated, and the sorption and reaction emitted/absorbed phonons are identified through spectral analysis of the surface atomic motion. Due to large bandgap, the atomic vibration (phonon) energy transfer channels dominate and among them is the match between the F/h-BN covalent bond stretching and the optical phonons. We show that the chemisorbed dissociation (the pathway activation ascent) requires absorption of large-energy optical phonons. Then using progressively heavier isotopes of B and N atoms, we show that limiting these high-energy optical phonons inhibits the chemisorbed dissociation, i.e., controllable phonocatalysis.
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
Characterization of an atomic hydrogen source for charge exchange experiments
We characterized the dissociation fraction of a thermal dissociation atomic hydrogen source by injecting the mixed atomic and molecular output of the source into an electron beam ion trap containing highly charged ions and recording the x-ray spectrum generated by charge exchange using a high-resolution x-ray calorimeter spectrometer. We exploit the fact that the charge exchange state-selective capture cross sections are very different for atomic and molecular hydrogen incident on the same ions, enabling a clear spectroscopic diagnostic of the neutral species.
46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
Development of a cryogenic hydrogen microjet for high-intensity, high-repetition rate experiments
Abstract Not Provided
MATSCI↗
Photoconductive and electro-optic effects in (Cd,Mg)Te single crystals measured in an experiment-on-chip configuration
We present our studies on both photoconductive (PC) and electro-optic (EO) responses of (Cd,Mg)Te single crystals. In an In-doped Cd 0.92 Mg 0.08 Te single crystal, subpicosecond electrical pulses were optically generated via a PC effect, coupled into a transmission line, and, subsequently, detected using an internal EO sampling scheme, all in the same (Cd,Mg)Te material. For photo-excitation and EO sampling, we used femtosecond optical pulses generated by the same Ti:sapphire laser with the wavelength 410 and 820 nm, respectively. The shortest transmission line distance between the optical excitation and EO sampling points was 75 μm. By measuring the transient waveforms at different distances from the excitation point, we calculated the transmission-line complex propagation factor, as well as the THz frequency attenuation factor and the propagation velocity, all of which allowed us to reconstruct the electromagnetic transient generated directly at the excitation point, showing that the original PC transient was subpicosecond in duration with a fall time of ~500 fs. Finally, the measured EO retardation, together with the amount of the electric-field penetration, allowed us to determine the magnitude of the internal EO effect in our (Cd,Mg)Te crystal. The obtained THz-frequency EO coefficient was equal to 0.4 pm/V, which is at the lower end among the values reported for CdTe-based ternaries, due to a twinned structure and misalignment of the tested (Cd,Mg)Te crystal.
71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
Hard x-ray bursts observed in association with Rayleigh-Taylor instigated current disruption in a solar-relevant lab experiment
Here, measurements by multiple X-ray detectors show transient emission of a 1 μs pulse of non-mono-energetic ~6 keV X-rays by a cold, dense MHD-driven plasma jet. Because the collision mean free path is much smaller than the jet dimensions, the acceleration of particles to high energy was not expected. The X-ray pulse occurs when the jet undergoes a kink instability which accelerates the jet laterally so that a fast-growing secondary Rayleigh-Taylor instability is triggered which then breaks the jet. The jet breaking is correlated in time with several other fast changing phenomena. It is proposed that despite the short collision mean free path, an inductive electric field associated with this breaking accelerates a certain subgroup of electrons to keV energies without any of these electrons undergoing collisions. Moreover, it is proposed that after being accelerated to high energy, these fast electrons are suddenly decelerated via collisions and radiate X-rays.
70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗