Statistical mechanics of charged traps in an amorphous semiconductor
Coulomb interaction effect between charged traps in amorphous semiconductor, noting state density reduction at Fermi energy
Srinivasan, G.↗
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Discharge pulse phenomenology
A model was developed which places radiation induced discharge pulse results into a unified conceptual framework. Only two phenomena are required to interpret all space and laboratory results: (1) radiation produces large electrostatic fields inside insulators via the trapping of a net space charge density; and (2) the electrostatic fields initiate discharge streamer plasmas similar to those investigated in high voltage electrical insulation materials; these streamer plasmas generate the pulsing phenomena. The apparent variability and diversity of results seen is an inherent feature of the plasma streamer mechanism acting in the electric fields which is created by irradiation of the dielectrics. The implications of the model are extensive and lead to constraints over what can be done about spacecraft pulsing.
Frederickson, A. R.↗
Gas release in comet nuclei
Processes taking place during the evolution of a comet nucleus are examined, taking into account the release of gas on crystallization and the gas flow through the porous nucleus. In particular, the stresses caused by the gas pressure, the contribution of gas flow to the heat transfer, and the rate of gas emission by the comet along its orbit were determined using a model of spherically symmetric comet nucleus made of porous amorphous ice, with 10 percent CO gas trapped in it. Several values of density and pore size are considered, and for each combination of parameters, the model is evolved for 20-30 revolutions in Comet P/Halley's orbit. It is shown that a model of 0.2 g/cu cm density reproduces well many of the light-curve and activity characteristics of Comet P/Halley.
Prialnik, Dina↗
Kinetic Modeling of Plasmaspheric Refilling
We have a new model of ion transport that we have applied to the problem of plasmaspheric flux tube refilling after a geomagnetic disturbance. Effects included are a time-varying ionospheric source, self-consistent Coulomb collisions, field-aligned electric field, and ion cyclotron wave heating. We see refilling rates similar to those of earlier observations and models, except when the electric field is included. In this case, the refilling rates are larger than previously predicted, yet still within the experimental limits. Wave interactions increase the trapped zone population and thus the density, especially during the few few hours of the refilling process. Results are compared with observations from DE/RIMS and Polar/TIDE, as well as hydrodynamic and kinetic particle model simulations.
Liemohn, M. W.↗
Effects of Proton Irradiation on the Performance of Skipper CCDs
Skipper CCDs are a mature detector technology that has been suggested for future space telescope instruments requiring sub-electron readout noise in the near-ultraviolet to the near-infrared. While modern skipper CCDs inherit from the radiation-tolerant p-channel detectors developed by LBNL, the effects of high doses of ionizing radiation on skipper CCDs (such as those expected in space) remains largely unmeasured. We report preliminary results on the performance of p-channel skipper CCDs following irradiation with 217-MeV protons at the Northwestern Medicine Proton Center. The total nonionizing energy loss (NIEL) experienced by the detectors exceeds 6 years at the Sun-Earth Lagrange Point 2 (L2). We demonstrate that the skipper amplifier continues to function as expected following this irradiation. Owing to the low readout noise of these detectors, controlled irradiation tests can be used to sensitively characterize the charge transfer inefficiency, dark current, and the density and time constants of charge traps as a function of proton fluence. We conclude with a brief outlook toward future tests of these detectors at other proton and gamma-ray facilities.
46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
Modeling of deuterium and carbon radiation transport in MAST-U tokamak advanced divertors
Modest effects of deuterium and carbon radiation opacity in the Super-X and snowflake divertor plasmas are predicted for MAST Upgrade tokamak with core plasma input power 2.5–5 MW and plasma current 1 MA. The radiation transport modeling is based on the SOLPS-EIRENE and UEDGE code divertor plasma predictions. Two radiation transport models are used: one is based on a full radiation transport equation implemented in the radiation transport and collisional-radiative code CRETIN (without feedback on the background plasma), and another is an internal self-consistent UEDGE model with ionization, recombination, and heating rates corrected for Ly α line trapping based on the escape probability model implemented in CRETIN. In MAST-U, the Super-X and snowflake divertor plasmas are predicted to reach detached regimes at lower upstream densities than the standard divertor, and the conclusion still holds with radiation transport effects included. At neutral densities m -3 , modest Ly α deuterium line trapping with optical depths 10–15 is predicted in the Super-X divertor. Divertor plasmas are optically thin to other Lyman and Balmer lines, as well as to strong C III and C IV lines that are responsible for most of divertor radiated power. Insignificant changes (within a few percent) to divertor deuterium ionization and recombination rates are found. Radiation fluxes on outer divertor target are modified within a factor of 2–3 when the radiation transport is accounted for, and a similar variation is found due to the line shape models that define the absorption and emission line profiles in the radiation transport modeling. The predicted Lyman and Balmer spectral intensities are significantly modified due to radiation trapping. A measurement of divertor radiation transport effects is discussed using the Ly β /Ba α line ratio. In the snowflake divertor configuration, divertor plasmas are found to be optically thin to Lyman series lines within a large range of parameter variations that include upstream density, divertor transport coefficients, and magnetic configurations. Finally, modest radiation transport effects are only found in a few cases with strongest divertor transport and magnetic configurations closest to the ideal snowflake configuration, however, the plasma background models that were used are yet to be validated with an experiment.
74 ATOMIC AND MOLECULAR PHYSICS↗
Tritium Trapping Thermodynamics by Point Defects at Interfacial Fe-Al Phases of the Aluminide Coating
Density functional theory (DFT) simulations have been carried out to evaluate the potential for tritium trapping by metal vacancies in four phases (i.e., (Fe, Cr, Ni), AlFe 3 , NiAl, and AlFe) identified near the interface between the Al coating and 316 stainless steel (316 SS) cladding. In addition, an ab initio thermodynamics approach has been employed to predict the temperature and T 2 -partial pressure dependence on the thermodynamics of tritiated defects. Key results in this work suggest that metal vacancies in the four phases have the potential to favorably trap tritium species. This thermodynamic trend can be correlated to the high energy cost of having an interstitial tritium in the lattice, which has been calculated to be at least 0.48 eV. By combining the results of this study with previous theoretical works investigating tritium behavior in other Fe-Al phases identified in the aluminide coating, suggest that metal vacancies are generally able to trap tritium in various Fe-Al aluminide phases. Especially, it was found that Al vacancies are the most efficient to trap tritium, followed by Fe vacancies, then Ni and Cr vacancies. Strong interactions between tritium and the metal vacancies are occurring by the formation of Fe—T bonds. The formation of Cr—T, Ni—T, or Al—T bonds are found less energetically favorable than Fe—T bonds.
22 GENERAL STUDIES OF NUCLEAR REACTORS↗
Nightside magnetosphere configuration as obtained from trapped electrons at 1100 kilometers.
Nightside magnetosphere configuration obtained from polar orbiting satellite 1963 38C data on trapped electrons at 1100 km
IONOSPHERIC ELECTRON DENSITY↗
Benchmarking the multiconfigurational Hartree method by the exact wavefunction of two harmonically trapped bosons with contact interaction
Highlights: • Comparison of exact and numerical single-particle density matrices. • Benchmark for multiconfigurational Hartree. • Convergence for large number of orbitals. We consider two bosons in a one-dimensional harmonic trap, interacting by a contact potential, and compare the exact solution of this problem to a self-consistent numerical solution by using the multiconfigurational time-dependent Hartree (MCTDH) method. We thereby benchmark the predictions of the MCTDH method with a few-body problem that has an analytical solution for the most commonly experimentally realized interaction potential in ultracold quantum gases. It is found that exact ground state energy and first order correlations are accurately reproduced by MCTDH up to the intermediate dimensionless coupling strengths corresponding to typical background scattering lengths of magnetically trapped ultracold dilute Bose gases. For larger couplings, established for example by (a combination of) Feshbach resonances and optical trapping, the MCTDH approach overestimates the depth of the trap-induced correlation dip of first order correlations in position space, as well as overestimates the fragmentation, defined as the average relative occupation of orbitals other than the energetically lowest one. We anticipate that qualitatively similar features in the correlation function may arise for larger particle numbers, paving the way for a quantitative assessment of the accuracy of MCTDH by experiments with ultracold atoms.
71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
1 / ω electric-field noise in surface ion traps from correlated adsorbate dynamics
Ion traps are promising architectures for implementing quantum computers, but they suffer from excessive “anomalous” ion motional heating that limit their overall coherence and practicality for scalable quantum computing. The exact microscopic origins of anomalous heating remain an open question, but experiments point to adsorbates on trap electrodes as one likely source. Many different models of anomalous heating have been proposed, but these models have yet to pinpoint the atomistic origin of the experimentally observed 1/ω electric-field noise scaling seen in ion traps at frequencies between 0.1–10 MHz. In this work, we show that a model based on previously proposed surface-induced dipole fluctuations on adsorbates, but which also incorporates interparticle interaction dynamics through molecular dynamics simulations of up to multiple monolayers of adsorbates, gives rise to 1/ω frequency scaling at the MHz frequencies typically employed in ion traps. Overall, these results demonstrate that moderate-to-high densities of adsorbates can give rise to a set of activated motions that produce the 1/ω noise observed in ion traps and that collective adsorbate motions produce the observed noise spectra that a noninteracting model does not capture.
36 MATERIALS SCIENCE↗
Thermal and suprathermal plasma densities in the outer magnetosphere
Using the low-frequency cutoff of electromagnetic noise trapped in the magnetosphere at frequencies above the local plasma frequency, it is now possible to make very accurate, + or - 1%, electron density measurements in the low density region between the magnetopause and plasmapause. This technique for measuring the total plasma density was used, together with measurements of the suprathermal proton intensities with the LEPEDEA instrumentation on the IMP-6 spacecraft, to determine the thermal proton densities in the region between the plasmapause and magnetopause. Although the thermal protons usually account for a significant fraction, approximately 50%, of the total proton density in this region, in some cases, particularly at the larger radial distances the density of the thermal protons sometimes drops to a very small fraction, 5%, of the total density and nearly all of the plasma consists of suprathermal particles.
Gurnett, D. A.↗
Charged particle diffusion and acceleration in Saturn's radiation belts
In the present paper, an attempt is made to determine, from the observed intensity profiles for protons and electrons in the region of L smaller than 4, whether population of Saturn's innermost trapped radiation zones from an external source is possible. It is found that if diffusion proceeds in an episodic rather than a steady-state manner (long periods of quiescence interrupted by brief periods of rapid diffusion), the basic features of the observed phase space density profiles are qualitatively reproduced for both the trapped protons and electrons.
Mckibben, R. B.↗
Control of the homopause level
The hypothesized responsibility of internal gravity wave breaking for upper atmosphere turbulence generation and the control of homopause level number density is considered. The lowest-order, equatorially trapped, westward-propagating diurnal tidal mode is the primary cause of the necessary turbulence on earth, while the lower-order, westward-propagating semidiurnal modes are the primary cause on Mars. The frequencies and vertical wavenumbers of the responsible modes determine the eddy diffusion coefficients, while energy density is only indirectly involved, by determining which modes can break. The breaking potential of tidal modes can be assessed by a general scale relationship between tidal heating and velocity amplitude which is presently employed as the basis for the suggestion that the number density of the Martian homopause is likely to have been stable over much of geologic time.
Leovy, C. B.↗
Thermal and suprathermal plasma densities in the outer magnetosphere
By using the low-frequency cutoff of electromagnetic noise trapped in the magnetosphere at frequencies above the local plasma frequency, it is now possible to make very accurate electron density measurements in the low density region between the magnetopause and plasmapause. This technique for measuring the total plasma density has been used, together with measurements of the suprathermal proton intensities with the Lepedea instrumentation on the Imp 6 spacecraft, to determine the thermal proton densities in the region between the plasmapause and magnetopause. Usually, the high-energy tail of the thermal proton distribution is sufficient intense to be detected at low energies within the Lepedea energy range. When the high-energy tail of the thermal distribution can be detected, it is possible to determine the temperature of the thermal protons. The temperature in a typical case is found to be 80,000 K. This high temperature for the thermal protons, which are presumably of ionospheric origin, agrees with earlier Ogo 5 measurements reported by Serbu and Maier (1970).
Gurnett, D. A.↗
Ab initio calculations of the rate of carrier trapping and release at dopant sites in NaI: Tl beyond the harmonic approximation
We present ab initio calculations of electron capture and release coefficients as a function of temperature for Tl dopants in the widely used scintillator NaI, which is a soft ionic crystal. The modelled capture and release events occur by transitions mediated by multiple phonon absorption and emission between states with significantly different local geometries around the trapping site. We demonstrate that such transitions are not well-described by the normal harmonic approximation to the nuclear dynamics. We avoid the harmonic approximation by numerically solving the vibrational Schrödinger equation for the motion along/of a single effective phonon coordinate. The localized trapped state is not correctly described by semilocal density functionals, so we employ a hybrid functional tuned to reproduce the band gap and lattice constant of the host material. Our calculations, which combine plane-wave and cluster electronic structure methods in a novel way, are in reasonable agreement with available experimental data for detrapping and predict an unusual temperature dependence for trapping rates.
Prange, Micah P.↗
Microstructure–Property Correlation in a Laser Powder Bed Fusion Processed High-Strength AF-9628 Steel
Laser powder bed fusion additive manufacturing (LPBF-AM) of a low-alloy, high-performance AF-9628 steel results in exceptionally high strength and good ductility. The reasons for such mechanical properties are investigated through detailed microscopy performed at several length scales. Thus, the characterization of melt pool, porosity, grain morphology, phases, and dislocations is performed in the as-printed material. The as-printed material consists of only 0.004 vol% of uniformly distributed porosity, single-phase martensitic laths with an average lath size of ≈2.5 μm, the absence of carbides indicating interstitial trapping of C atom, and high dislocation density in the martensitic laths. Experimental data through microscopy are then fed in analytical models for calculating strengthening contributions from various strengthening mechanisms. Calculated yield strength agrees well with experimentally determined value, and therefore, activation of various strengthening mechanisms is established in as-printed AF-9628.
36 MATERIALS SCIENCE↗
Engineering Assembly Kinetics and Line Roughness in Solvent Vapor-Annealed Block Copolymer/Homopolymer Blends
Block copolymer (BCP) directed self-assembly (DSA) is a promising route to enhance lithography resolution by multiplying nanopattern density and reducing feature roughness. Eliminating kinetically trapped self-assembly defects requires fast self-assembly. However, acceleration strategies like solvent vapor annealing or homopolymer blending broaden domain interfaces, implying a trade-off in increased feature roughness. In this work, we experimentally investigate this apparent dilemma between self-assembly kinetics and line roughness for solvent vapor-annealed thin films of a lamellar poly(styrene-block-2-vinylpyridine) (PS-b-P2VP) BCP blended with PS and P2VP homopolymers. Binary blends with PS or P2VP homopolymers and ternary blends incorporating both in equal weight fractions were solvent vapor annealed using acetone, a near-neutral solvent for PS and P2VP, followed by P2VP-selective vapor-phase infiltration with alumina (AlOx) and polymer etching. Binary blends with P2VP exhibit a modest kinetic enhancement but also higher line-edge and -width roughness due to the increased frequency of P2VP protrusions and bridge defects in the alumina line patterns. In contrast, binary blends with PS self-assemble noticeably faster, while domain asymmetry from the added PS homopolymer reduces roughness by curbing the number of alumina protrusions and bridge defects. Ternary blends maintain DSA line patterns across a wider composition window and, at higher homopolymer loadings, reduce roughness at length scales near the lamellar period, consistent with a reduced impact of intradomain compositional fluctuations. These findings provide important insights for codesigning blend compositions and process flows to achieve high-resolution, defect free patterns with minimal roughness through BCP DSA.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Kinetic analyses for solid-state phase transition of metastable amorphous-AlO x (2.5 < x ≤ 3.0) nanostructures into crystalline alumina polymorphs
Solid-solid phase change materials (SS-PCMs) hold promise for energy storage/dissipation in batteries and energetic materials. Yet, phase change kinetics for SS-PCMs undergoing metastable to semi-stable/stable phase transformations remain relatively ill-studied because trapping metastable phases remain challenging. Recently, we demonstrated the kinetic entrapment and stabilization of a highly disordered and amorphous Al-oxide phase m-AlO x @C (x~2.5-3.0) via laser ablation synthesis in solution (LASiS). We report here, to our knowledge, the first chemical kinetics analysis for S-S phase transition of the m-AlO 3 @C nanocomposites (< 5–8 nm sizes) into semi-stable equilibrium alumina phases (θ/γ-Al 2 O 3 ) via disproportionation reaction, while releasing excess trapped gases. Our results indicate the atomic density of the AlO 3 structures to be ~5–10 times less than that of the final Al 2 O 3 phases, which led to the hypothesis of a volume shrinkage process during their phase transition. Temperature-dependent X-ray diffraction studies reveal the high-temperature phase transition for m-AlO 3 → θ/γ-Al 2 O 3 to follow contracting volume kinetics model, thereby validating our earlier hypothesis. Using the geometric volume contraction model, reaction kinetics analyses from Arrhenius plots reveal the activation energy barrier for the phase transition to be ~270±11 kJ/mol. This makes the activation energy barrier nearly identical to the oxidation of micron-sized Al particles.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗