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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 613 records · Page 34

Excess carrier concentration in silicon devices and wafers: How bulk properties are expected to accelerate light and elevated temperature degradation

Light and elevated temperature induced degradation (LeTID) is accelerated nearly linearly by the presence of excess carriers. It is therefore important to understand how excess carrier concentration (Δn) changes as a function of exposure conditions, materials properties, and sample structure. We simulate Δn as a function of wafer thickness and bulk minority carrier lifetime (τ) in solar cells and wafers using SCAPS and Quokka3. We also derive closed-form analytic expressions. For wafers, there is a near-linear relationship between Δn and τ or thickness, whereas for solar cells, Δn in the bulk may become limited by rear surface recombination. Thus, LeTID may progress more quickly in wafers than in cells, with a stronger dependence on τ. When comparing experiments, observed degradation rates must be corrected between samples or conditions to account for differences in Δn. This study demonstrates three tools to estimate the magnitude of such corrections, which can aid in the quantitative interpretation of LeTID data and performance predictions. Finally, while each tool yields similar results, there are advantages to each approach that must be weighed in terms of simplicity of inputs versus sophistication of treatment. Incomplete specification of back contact characteristics in commercial products is identified as an important contributor to uncertainty in expected LeTID rates.

36 MATERIALS SCIENCE↗

Using emergent order to shape a space society

A fast-growing movement in the scientific community is reshaping the way that we view the world around us. The short-hand name for this movement is 'chaos'. Chaos is a science of the global, nonlinear nature of systems. The center of this set of ideas is that simple, deterministic systems can breed complexity. Systems as complex as the human body, ecology, the mind or a human society. While it is true that simple laws can breed complexity, the other side is that complex systems can breed order. It is the latter that I will focus on in this paper. In the past, nonlinear was nearly synonymous with unsolvable because no general analytic solutions exist. Mathematically, an essential difference exists between linear and nonlinear systems. For linear systems, you just break up the complicated system into many simple pieces and patch together the separated solutions for each piece to form a solution to the full problem. In contrast, solutions to a nonlinear system cannot be added to form a new solution. The system must be treated in its full complexity. While it is true that no general analytical approach exists for reducing a complex system such as a society, it can be modeled. The technical involves a mathematical construct called phase space. In this space stable structures can appear which I use as analogies for the stable structures that appear in a complex system such as an ecology, the mind or a society. The common denominator in all of these systems is that they rely on a process called feedback loops. Feedback loops link the microscopic (individual) parts to the macroscopic (global) parts. The key, then, in shaping a space society, is in effectively using feedback loops. This paper will illustrate how one can model a space society by using methods that chaoticists have developed over the last hundred years. And I will show that common threads exist in the modeling of biological, economical, philosophical, and sociological systems.

Graps, Amara L.↗

Evaluation of phenolic antioxidant capacity in beverages based on laccase immobilized on screen-printed carbon electrode modified with graphene nanoplatelets and gold nanoparticles

A simple and highly sensitive electrochemical biosensor based on laccase immobilized onto a gold nanoparticles/graphene nanoplatelets-modified screen-printed carbon electrode (LACC/AuNP/GNPl/SPCE) was developed for the determination of hydroquinone (HQ) and other phenolic compounds. The biosensor shows excellent electro-catalytic activity towards oxidation of hydroquinone at a potential of -0.05 V (vs Ag/AgCl, 3 M KCl) in phosphate buffer as supporting electrolyte (0.1 M, pH 7.0) using hydrodynamic amperometry. Analytical characteristics uncover that the LACC/AuNP/GNPl/SPCE comprises a wide linear range for the dependence of the signal on HQ concentrations from 4 to 130 µM with a detection limit (3σ) of 1.5 µM. The repeatability (5 measurements, 100 µM hydroquinone) is ±2% and the reproducibility (5 biosensors, 100 µM hydroquinone) is ±3%. Interference studies of most common compounds with the determination of hydroquinone demonstrated negligible effects. Finally, the biosensor and the analytical method were applied to the determination of phenolic antioxidant capacity (AOC) in wine and blueberry syrup based on Trolox (6‑hydroxy‑2,5,7,8-tetramethylchromane-2-carboxylic acid) and hydroquinone equivalents. The results were evaluated by using their calibration curves which were satisfactory and agreed well with the results obtained by the reference method Trolox Equivalent Antioxidant Capacity assay (TEAC-Assay).

60 APPLIED LIFE SCIENCES↗

Development of a continuous linear model of a d-c to d-c flyback converter.

The analytical design of the feedback circuit for a d-c flyback converter requires the formulation of a model defining the static and dynamic performance of the forward loop. This paper describes the steps which were taken to develop a linear continuous model of a typical flyback circuit. Although the method uses several approximations to simplify the work, the resulting model was found to duplicate the performance of the actual circuit very closely. The model makes it possible to design the feedback circuit using well known linear feedback techniques. The method is an extension of prior work in the modeling of pulse-width controlled circuits.

Wells, B. A.↗

Dirac equation for the harmonic scalar and vector potentials and linear plus coulomb-like tensor potential; the SUSY approach

The problem of analytical solutions of the 3-dimensional Dirac equation is usually studied via techniques such as The Nikiforov-Uvarov (NU) method. Here, we see that one of the most attractive potentials can be brought into a well-known form of Schroedinger-like problem possessing known solutions via the methodology of supersymmetry (SUSY). Next, using the idea of shape invariance, we calculate exact solutions of Dirac equation for quadratic scalar and vector potentials in the presence of a tensor potential that depends on the radial component either linearly or inversely. The tensor potential itself, besides its applications, removes degeneracy, too.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Electron cyclotron resonance near the axis of a quadrupole linear trap

The quasi-longitudinal propagation of an extraordinary electromagnetic wave in the vicinity of the electron cyclotron resonance layer in an open linear trap with a quadrupole magnetic field is studied analytically, taking into account the inhomogeneity of the magnetic field in a paraxial approximation. The ray trajectories are derived from a simplified dispersion equation, that is, nonetheless able to accurately describe the transition from finite to zero perpendicular refractive index. A criterion for an on-axis resonance point to be an attractor for the ray trajectories is formulated, which generalizes a similar criterion for axisymmetric linear traps derived in a recent paper [D. S. Bagulov and I. A. Kotelnikov, Phys. Plasmas 19, 082502 (2012)].

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

An analytic formula for H-infinity norm sensitivity with applications to control system design

An analytic formula for the sensitivity of singular value peak variation with respect to parameter variation is derived. As a corollary, the derivative of the H-infinity norm of a stable transfer function with respect to a parameter is presented. It depends on some of the first two derivatives of the transfer function with respect to frequency and the parameter. For cases when the transfer function has a linear system realization whose matrices depend on the parameter, analytic formulas for these first two derivatives are derived, and an efficient algorithm for calculating them is discussed. Examples are given which provide numerical verification of the H-infinity norm sensitivity formula and which demonstrate its utility in designing control systems satisfying H-infinity norm constraints. In the appendix, derivative formulas for singular values are paraphrased.

Giesy, Daniel P.↗

Dynamics of protein aggregation and oligomer formation governed by secondary nucleation

The formation of aggregates in many protein systems can be significantly accelerated by secondary nucleation, a process where existing assemblies catalyse the nucleation of new species. In particular, secondary nucleation has emerged as a central process controlling the proliferation of many filamentous protein structures, including molecular species related to diseases such as sickle cell anemia and a range of neurodegenerative conditions. Increasing evidence suggests that the physical size of protein filaments plays a key role in determining their potential for deleterious interactions with living cells, with smaller aggregates of misfolded proteins, oligomers, being particularly toxic. It is thus crucial to progress towards an understanding of the factors that control the sizes of protein aggregates. However, the influence of secondary nucleation on the time evolution of aggregate size distributions has been challenging to quantify. This difficulty originates in large part from the fact that secondary nucleation couples the dynamics of species distant in size space. Here, we approach this problem by presenting an analytical treatment of the master equation describing the growth kinetics of linear protein structures proliferating through secondary nucleation and provide closed-form expressions for the temporal evolution of the resulting aggregate size distribution. We show how the availability of analytical solutions for the full filament distribution allows us to identify the key physical parameters that control the sizes of growing protein filaments. Furthermore, we use these results to probe the dynamics of the populations of small oligomeric species as they are formed through secondary nucleation and discuss the implications of our work for understanding the factors that promote or curtail the production of these species with a potentially high deleterious biological activity.

60 APPLIED LIFE SCIENCES↗

Linearized stability analysis and design of a flyback dc-dc boost regulator.

Analytic expressions for the small-signal power-stage describing functions of a switched dc-dc boost regulator are derived from an approximate continuous circuit model which is developed by a time-averaging technique. Closed-loop stability is attained through the design of frequency compensation of the loop gain. Open- and closed-loop regulator output impedances are derived from the linearized models for the given configuration. The analysis and design are compared with and confirmed by breadboard measurements.

Wester, G. W.↗

Quantification of Native Lignin Structural Features with Gel–Phase 2D–HSQC 0 Reveals Lignin Structural Changes During Extraction

Our ability to study and valorize the lignin fraction of biomass is hampered by the fundamental and still unmet challenge of precisely quantifying native lignin's structural features. Here, we developed a rapid elevated-temperature 1 H– 13 C Heteronuclear Single-Quantum Coherence Zero (HSQC 0 ) NMR method that enables this precise quantification of native lignin structural characteristics even with whole plant cell wall (WPCW) NMR spectroscopy, overcoming fast spin relaxation in the gel phase. We also formulated a Gaussian fitting algorithm to perform automatic and reliable spectral integration. By combining HSQC 0 measurements with yield measurements following depolymerisation, we can confirm the combinatorial nature of radical coupling reactions during biosynthesis leading to a random sequential organization of linkages within a largely linear lignin chain. Such analyses illustrate how this analytical method can greatly facilitate the study of native lignin structure, which can then be used for fundamental studies or to understand lignin depolymerization methods like reductive catalytic fractionation or aldehyde-assisted fractionation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Quantification of Native Lignin Structural Features with Gel–Phase 2D–HSQC 0 Reveals Lignin Structural Changes During Extraction

Our ability to study and valorize the lignin fraction of biomass is hampered by the fundamental and still unmet challenge of precisely quantifying native lignin's structural features. Here, we developed a rapid elevated-temperature 1 H– 13 C Heteronuclear Single-Quantum Coherence Zero (HSQC 0 ) NMR method that enables this precise quantification of native lignin structural characteristics even with whole plant cell wall (WPCW) NMR spectroscopy, overcoming fast spin relaxation in the gel phase. We also formulated a Gaussian fitting algorithm to perform automatic and reliable spectral integration. By combining HSQC 0 measurements with yield measurements following depolymerisation, we can confirm the combinatorial nature of radical coupling reactions during biosynthesis leading to a random sequential organization of linkages within a largely linear lignin chain. Such analyses illustrate how this analytical method can greatly facilitate the study of native lignin structure, which can then be used for fundamental studies or to understand lignin depolymerization methods like reductive catalytic fractionation or aldehyde-assisted fractionation.

09 BIOMASS FUELS↗

Meta-analysis of biogas upgrading to renewable natural gas through biological CO 2 conversion

Biogas upgrading through CO 2 conversion by hydrogenotrophic methanogenesis is receiving an increasing attention worldwide because of the demand for renewable natural gas. Herein, a holistic and statistical study of the operation conditions, driving forces, performances, and potential implementation of biogas upgrading via biological CO 2 conversion was conducted. Based on a systematic review and meta-analysis of 46 existing publications that were selected from 1475 papers, we have compiled a global dataset of CO 2 bioconversion biogas upgrading, encompassing 308 study cases. Subsequently, we employed a rigorous analytical framework incorporating data processing and mixed effects linear regression analysis to examine the dataset. This analysis revealed a significant positive relationship between the H 2 :CO 2 ratio and the methane percentage in the upgraded biogas when using the study as a random effect. Furthermore, we performed meta-analysis on observations taken when the ratio was close to 4:1 and found that ex situ reactors (91.93% [88.11%, 95.75%]) can perform better than in situ reactors (84.74% [80.69%, 88.80%]). No evidence of differential performance was found based on the present dataset between different temperature regimes or operation modes. Furthermore, those findings establish a database that will contribute to a deeper understanding of the biogas upgrading via biological CO 2 conversion.

Biogas upgrading↗

High-order limiting methods using maximum principle bounds derived from the Boltzmann equation I: Euler equations

The use of limiting methods for high-order numerical approximations of hyperbolic conservation laws generally requires defining an admissible region/bounds for the solution. In this work, we present a novel approach for computing solution bounds and limiting for the Euler equations through the kinetic representation provided by the Boltzmann equation, which allows for extending limiters designed for linear advection directly to the Euler equations. Given an arbitrary set of solution values to compute bounds over (e.g., numerical stencil) and a desired linear advection limiter, the proposed approach yields an analytic expression for the admissible region of particle distribution function values, which may be numerically integrated to yield a set of bounds for the density, momentum, and total energy. Further, these solution bounds are shown to preserve positivity of density/pressure/internal energy and, when paired with a limiting technique, can robustly resolve strong discontinuities while recovering high-order accuracy in smooth regions without any ad hoc corrections (e.g., relaxing the bounds). This approach is demonstrated in the context of an explicit unstructured high-order discontinuous Galerkin/flux reconstruction scheme for a variety of difficult problems in gas dynamics, including cases with extreme shocks and shock-vortex interactions. Furthermore, this work presents a foundation for limiting techniques for more complex macroscopic governing equations that can be derived from an underlying kinetic representation for which admissible solution bounds are not well-understood.

42 ENGINEERING↗

A process to verify numerical models for seismic fluid-structure interaction in advanced reactor vessels

Seismic design and qualification of a liquid-filled advanced nuclear reactor will have to account for fluid-structure interaction (FSI). Interaction between the tank, internal components, and contained liquid will rely on analysis of numerical models that must be verified and validated. Here this study demonstrates a verification process for models of a base-supported cylindrical tank by comparing numerical predictions and analytical solutions. The numerical models are consistent with the assumptions made to derive analytical solutions, namely, either a rigid or a linear elastic tank, ideal fluid, and small-amplitude, unidirectional, horizontal inputs. One software platform is used to illustrate the process. Seismic FSI analysis is performed using the Arbitrary Lagrangian-Eulerian (ALE) and Incompressible Computational Fluid Dynamics (ICFD) solvers in LS-DYNA. Reported responses are those used for design, including hydrodynamic pressures on the tank wall, shear forces and moments at the tank base, and wave heights of the contained liquid. The accuracy of the numerical results is discussed. The numerical models are verified for calculating the pressures on the tank wall and reactions at its base. Accurate simulation of wave action is challenging for both solvers. Recommendations for modeling, code development, and steps for verification are provided. Although focused on reactor vessels and one software platform, the verification process described herein is broadly applicable to liquid-filled vessels and other finite element codes.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Plasma response to nonlinear time-periodic electric fields in one dimension

Plasma response to spatially nonuniform time-periodic electric fields is of importance in many applications. For the case of a spatially linear monochromatic electric field in Paul traps, exact analytic expressions for the time-dependent plasma distribution function have been recently obtained [K. Shah and H. S. Ramachandran, Phys. Plasmas 15, 062303 (2008)]. In this paper, the problem of plasma response to a one-dimensional time-periodic electric field with a general spatial dependence is considered and analytic expressions for the time-averaged plasma distribution function and density are derived by solving the Vlasov equation under two limiting cases of high and low frequencies. Under this approximation, it is shown that the time-averaged plasma density is a function of the square of the oscillatory electric potential.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

A resistive instability of lower hybrid-like waves in regions with parallel currents

The resistive instabilities and dispersion of obliquely propagating waves near the lower hybrid (LH) frequency are studied in plasma carrying a current parallel to the magnetic field. Possible applications of these instabilities include magnetic reconnection regions where LH-like waves may accelerate and heat both ions and electrons. A resistive instability is found in one of the four LH-like wave modes for electron drift speeds several times greater than the electron thermal speed for representative parameters. Numerical fully electromagnetic kinetic calculations of the solutions to the linear dispersion equation are compared with more approximate analytic calculations and show good agreement. The analytic results indicate that ion magnetization effects play a critical role in the resistive instability.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Quantum ring solitons and nonlocal effects in plasma wake field excitations

A theoretical investigation of the quantum transverse beam motion for a cold relativistic charged particle beam travelling in a cold, collisionless, strongly magnetized plasma is carried out. This is done by taking into account both the individual quantum nature of the beam particles (single-particle uncertainty relations and spin) and the self consistent interaction generated by the plasma wake field excitation. By adopting a fluid model of a strongly magnetized plasma, the analysis is carried out in the overdense regime (dilute beams) and in the long beam limit. It is shown that the quantum description of the collective transverse beam dynamics is provided by a pair of coupled nonlinear governing equations. It comprises a Poisson-like equation for the plasma wake potential (driven by the beam density) and a 2D spinorial Schroedinger equation for the wave function, whose squared modulus is proportional to the beam density, that is obtained in the Hartree's mean field approximation, after disregarding the exchange interactions. The analysis of this pair of equations, which in general exhibits a strong nonlocal character, is carried out analytically as well as numerically in both the linear and the nonlinear regimes, showing the existence of the quantum beam vortices in the form of Laguerre-Gauss modes and ring envelope solitons, respectively. In particular, when the relation between the plasma wake field response and the beam probability density is strictly local, the pair of the governing equations is reduced to the 2D Gross-Pitaevskii equation that allows one to establish the conditions for the self focusing and collapse. These conditions include the quantum nature of the beam particles. Finally, when the relation between the plasma wake field response and the beam probability density is moderately nonlocal, the above pair of equations permits to follow the spatio-temporal evolution of a quantum ring envelope soliton. Such a structure exhibits small or violent breathing, but it remains very stable for long time.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Plasma turbulence in the scrape-off layer of tokamak devices

Plasma turbulence is explored in the scrape-off layer of tokamak devices using three-dimensional global two-fluid simulations. Two transport regimes are discussed: one in which the turbulent fluctuations saturate nonlinearly due to the Kelvin-Helmholtz instability, and another in which the fluctuations saturate due to a local flattening of the plasma gradients and associated removal of the linear instability drive. Focusing on the latter regime, analytical estimates of the cross-field transport and plasma profile gradients are obtained that display Bohm-scaling diffusion properties.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗