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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 163 records · Page 9
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Theoretical analysis of the saturation phase of the 1/1 energetic-ion-driven resistive interchange mode

The aim of the present study is to analyze the saturation regime of the energetic-ion-driven resistive interchange mode (EIC) in the LHD plasma. In this work, a set of nonlinear simulations are performed by the FAR3d code that uses a reduced MHD model for the thermal plasma coupled with a gyrofluid model for the energetic particle (EP) species. The hellically trapped EP component is introduced through a modification of the averaged drift velocity operator to include their precessional drift. The nonlinear simulation results show similar 1/1 EIC saturation phases with respect to the experimental observations, reproducing the enhancement of the n/m = 1/1 resistive interchange modes (RIC) amplitude and width as the EP β increases, the EP β threshold for the 1/1 EIC excitation, the further destabilization of the 1/1 EIC as the population of the helically trapped EP increases and the triggering of burst events. The frequency of the 1/1 EIC calculated during the burst event is 9.4 kHz and the 2/2 and 3/3 overtones are destabilized, consistent with the frequency range and the complex mode structure measured in the experiment. In addition, the simulation shows the inward propagation of the 1/1 EIC due to the nonlinear destabilization of the 3/4 and 2/3 energetic particle modes, leading to the partial overlapping between resonances during the burst event. Finally, the analysis of the 1/1 EIC stabilization phase shows the excitation of the 1/1 RIC as soon as the flattening induced by the 1/1 EIC in the pressure profile vanishes, leading to the retrieval of the pressure gradient at the plasma periphery and the overcoming of the RIC stability limit.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2023

Analysis of beam ion driven Alfvén eigenmode stability induced by Tungsten contamination in EAST

Alfvén eigenmodes (AE) activity is observed in the EAST high β N and low B T discharge 93910, operation scenario dedicated to explore the ITER baseline scenario. AEs are triggered after the plasma is contaminated by Tungsten that causes an abrupt variation of the thermal plasma and energetic particles (EPs) profiles. The aim of the present study is to analyze the AE stability in the 93910 discharge using the gyro-fluid code FAR3d, identifying the AE stability trends by comparing the plasma before and after the Tungsten contamination. Tungsten contamination causes the destabilization of Toroidal AEs (TAE) and Energetic particle modes (EPMs) in the same frequency range and radial location with respect to the experimental observation and M3D-K/GTAW code results. Next, a set of parametric studies are performed to analyze the effect of the thermal plasma and EP parameters on the AE stability. The analysis indicates a lower EP β threshold for the AEs destabilization if the EP energy increases, an improved AE stability of on-axis NBI configurations due to the stronger continuum damping in the inner plasma region as well as a large enhancement of the EP drive as the thermal ion density increases due to a higher ratio of the EP and Alfven velocities. Consequently, the simulations indicate the increment of the thermal ion density after the Tungsten contamination could be the main cause of the AE/EPM destabilization.

AE↗
DOE OSTI2021

Effect of natural mutations of SARS-CoV-2 on spike structure, conformation, and antigenicity

Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) variants with multiple spike mutations enable increased transmission and antibody resistance. We combined cryo–electron microscopy (cryo-EM), binding, and computational analyses to study variant spikes, including one that was involved in transmission between minks and humans, and others that originated and spread in human populations. All variants showed increased angiotensin-converting enzyme 2 (ACE2) receptor binding and increased propensity for receptor binding domain (RBD)–up states. While adaptation to mink resulted in spike destabilization, the B.1.1.7 (UK) spike balanced stabilizing and destabilizing mutations. A local destabilizing effect of the RBD E484K mutation was implicated in resistance of the B.1.1.28/P.1 (Brazil) and B.1.351 (South Africa) variants to neutralizing antibodies. Our studies revealed allosteric effects of mutations and mechanistic differences that drive either interspecies transmission or escape from antibody neutralization.

59 BASIC BIOLOGICAL SCIENCES↗
NASA NTRS1975

Hot-cold plasma interactions in the earth's magnetosphere

The paper gives a synopsis of observations and results obtained from the Explorer-45 satellite which pertain directly to the interaction of the magnetospheric hot and cold plasma populations. The specific case discussed is the interaction of the hot ring current plasma with the cold plasmaspheric plasma in the evening to early morning local time sector during magnetic storm recovery phase. It was found that above the plasmapause region, the hot ring current plasma is stable with negligible losses due to pitch angle diffusion; the hot ring current plasma enters a moderate pitch angle regime in the plasmapause region, whereby the addition of cold plasma destabilizes the hot plasma. Analysis of the energy, spatial, and temporal dependence of the above destabilization along with the ion-cyclotron resonant energy equation, and comparison of this analysis with an in situ estimate of the plasma density strongly indicate that the mechanism responsible for destabilization of the hot plasma is the amplification of ion-cyclotron waves due to the interaction of the cold plasmaspheric plasma with the hot ring current plasma in a manner similar to that discussed by Cornwall et al. (1970).

Williams, D. J.↗
NASA NTRS1989

Buoyancy effects on morphological instability during directional solidification

The onset of morphological instability during the directional solidification of a single-phase binary alloy at constant velocity vertically upwards is treated by a linear stability analysis. The case in which a heavier solute is rejected at the solidifying interface is considered, and the effect of natural convection on the critical concentration for the onset of instability is studied. For tin containing lead, a small destabilization of the system at low growth velocities, and a large increase in the wavelength of the instability at the onset are found. Calculations show that the destabilization is enhanced as the variation of density with solute concentration is reduced, and in the limit of neutrally-dense solute, there is a long wavelength instability for which the critical solute concentration is several orders of magnitude lower than that predicted by the Mullins and Sekerka (1964) analysis in the absence of convection. For the neutrally-dense solute, a simplified analysis indicates the roles played by the interface deformation and thermal convection in promoting the instability. In particular, the destabilization is very sensitive to the ratio of crystal and melt thermal conductivities.

Coriell, S. R.↗
NASA NTRS1993

Linear stability of three-dimensional boundary layers - Effects of curvature and non-parallelism

In this paper we study the effect of in-plane (wavefront) curvature on the stability of three-dimensional boundary layers. It is found that this effect is stabilizing or destabilizing depending upon the sign of the crossflow velocity profile. We also investigate the effects of surface curvature and nonparallelism on crossflow instability. Computations performed for an infinite-swept cylinder show that while convex curvature stabilizes the three-dimensional boundary layer, nonparallelism is, in general, destabilizing and the net effect of the two depends upon meanflow and disturbance parameters. It is also found that concave surface curvature further destabilizes the crossflow instability.

Malik, M. R.↗
NASA NTRS1959

An Investigation of the Pitching-Moment Contribution of a High Horizontal Tail on an Unswept-Wing and Body Combination at Mach Numbers from 0.80 to 1.40

An investigation has been conducted to determine the effects of a high positioned horizontal tail on a wing-body configuration having a thin unswept wing of aspect ratio 3.09. Lift and pitching-moment coefficients were obtained for Mach numbers from 0.80 to 1.40 at Reynolds numbers of 1.0 and 1.5 million and for angles of attack to 20 deg. An experimental study of the pitching-moment contribution of the horizontal tail indicated that the marked destabilizing effect of the horizontal tail at high angles of attack for Mach numbers of 0.80 to 1.00 was associated with the formation of completely separated flow on the upper surface of the wing. Computations of the interference effects of the wing-body combination on the tail for Mach numbers of 0.80 and 0.94 and high angles of attack confirmed this conclusion. For a Mach number of 1.40, and high angles of attack, computations disclosed that the destabilizing effect primarily resulted from the trailing vortices of the wing. Two modifications to the basic wing plan form, which consisted of chord extensions, were generally unsuccessful in reducing the destabilizing contributions of the horizontal tail at high angles of attack.

Lippmann, Garth W.↗
NASA NTRS2004

Turbine Engine Stability/Instability With Rub Forces Axisymmetric Rotor-Support Stiffness

The stability/instability condition of a turbine rotor with axisymmetric supports is determined in the presence of gyroscopic loads and rub-induced destabilizing forces. A modal representation of the turbine engine is used, with one mode in each of the vertical and horizontal planes. The use of non-spinning rotor modes permits an explicit treatment of gyroscopic effects. The two linearized modal equations of motion of a rotor with axisymmetric supports are reduced to a single equation in a complex variable. The resulting eigenvalues yield explicit expressions at the stability boundary, for the whirl frequency as well as the required damping for stability in the presence of the available rub-induced destabilization. Conversely, the allowable destabilization in the presence of the available damping is also given.

Gallardo, Vicente↗
NASA NTRS2005

Turbomachinery Application of Lagrangian Dynamics to the Motion of Continuous Discrete Rotors

The stability/instability condition of a turbine rotor with axisymmetric supports is determined in the presence of gyroscopic loads and rub-induced destabilizing forces. A modal representation of the turbine engine is used, with one mode in each of the vertical and horizontal planes. The use of non-spinning rotor modes permits an explicit treatment of gyroscopic effects. The two linearized modal equations of motion of a rotor with axisymmetric supports are reduced to a single equation in a complex variable. The resulting eigenvalues yield explicit expressions at the stability boundary, for the whirl frequency as well as the required damping in the presence of the available rub-induced destabilization. Conversely, the allowable destabilization in the presence of the available damping is also given.

Source record↗
NASA NTRS1993

Partially Grooved Domain Stabilization Structures for Vertical Bloch Line Memory

Bias field stability ranges were measured and numerically simulated for magnetic domains ingarnets stabilized by partially grooved rectangular and ring grooves. Simulation results agreefavorably with experimental results when finite slope effects of the groove walls are included. Asbias fields increase, rectangular and ring domains both destabilize through stripe head recession. Asbias fields decrease, destabilization in rectangular domains occurs by runout, while destabilization inring domains occurs by midstripe domain buckling. While ring domains are stable at lower biasfields than rectangular domains, bias field stability ranges are approximately equal. Hence, for thesame partial grooving depth, rectangular domains are preferred because they offer higher storagedensity potential in Vertical Block Line (VBL) storage arrays as long as bit propagation margins atstripe ends are sufficient.

Katti, R. R.↗
NASA NTRS2009

Analysis of Potential for Titanium Liner Buckling after Proof in a Large Kevlar/Epoxy COPV

We analyze the potential for liner buckling in a 40-in Kevlar49/epoxy overwrapped spherical pressure vessel (COPV) due to long, local depressions or valleys in the titanium liner, which appeared after proof testing (autofrettage). We begin by presenting the geometric characteristics of approximately 20 mil (0.02 in.) deep depressions measured by laser profilometry in several vessels. While such depths were more typical, depths of more than 40 mils (0.02 in.) were seen near the equator in one particular vessel. Such depressions are largely the result of overlap of the edges of overwrap bands (with rectangular cross-section prepreg tows) from the first or second wrap patterns particularly where they start and end. We then discuss the physical mechanisms of formation of the depressions during the autofrettage process in terms of uneven void compaction in the overwrap around the tow overlap lines and the resulting 10-fold increase in through-thickness stiffness of the overwrap. We consider the effects of liner plastic yielding mechanisms in the liner on residual bending moments and interface pressures with the overwrap both at the peak proof pressure (approx.6500 psi) and when reducing the pressure to 0 psi. During depressurization the Bauschinger phenomenon becomes very important whereby extensive yielding in tension reduces the magnitude of the yield threshold in compression by 30 to 40%, compared to the virgin annealed state of the liner titanium. In the absence of a depression, the liner is elastically stable in compression even at liner overwrap interface pressures nominally 6 times the approx. 1000 psi interface pressure that exists at 0 psi. Using a model based on a plate-on-an-elastic-foundation, we develop an extensive analysis of the possible destabilizing effects of a frozen-in valley. The analysis treats the modifying effects of the residual bending moments and interface pressures remaining after the proof hold as well as the Bauschinger effect on the compressive yield threshold. The key result is that depression depths of up to 40 mils can be tolerated, but above 40 mils, the Bauschinger effect drives destabilization, and buckling becomes increasingly likely depending on the details of depression formation during autofrettage. It is almost certain that destabilization and buckling will occur for depression depths beyond 55 mils. The main equations and formulas for treating the various phases of depression development and potential buckling, are only briefly outlined in the paper, but are available from the authors.

Phoenix, S. Leigh↗
NASA NTRS2017

Stabilization of Hypersonic Boundary Layers by Linear and Nonlinear Optimal Perturbations

The effect of stationary, finite-amplitude, linear and nonlinear optimal perturbations on the modal disturbance growth in a Mach 6 axisymmetric flow over a 7 deg. half-angle cone with 0:126 mm nose radius and 0:305 m length is investigated. The freestream parameters (M = 6, Re(exp 1) = 18 x 10(exp. 6) /m) are selected to match the flow conditions of a previous experiment in the VKI H3 hypersonic tunnel. Plane-marching parabolized stability equations are used in conjunction with a partial-differential equation based planar eigenvalue analysis to characterize the boundary layer instability in the presence of azimuthally periodic streaks. The streaks are observed to stabilize nominally planar Mack mode instabilities, although oblique Mack mode and first-mode disturbances are destabilized. Experimentally measured transition onset in the absence of any streaks correlates with an amplification factor of N = 6 for the planar Mack modes. For high enough streak amplitudes, the transition threshold of N = 6 is not reached by the Mack mode instabilities within the length of the cone; however, subharmonic first-mode instabilities, which are destabilized by the presence of the streaks, do reach N = 6 near the end of the cone. The highest stabilization is observed at streak amplitudes of approximately 20 percent of the freestream velocity. Because the use of initial disturbance profiles based on linear optimal growth theory may yield suboptimal control in the context of nonlinear streaks, the computational predictions are extended to nonlinear optimal growth theory. Results show that by using nonlinearly optimal perturbation leads to slightly enhanced stabilization of plane Mack mode disturbances as well as reduced destabilization of subharmonic first-mode disturbances.

Incompressible boundary layer↗
DOE OSTI2017

Protein Mutation Stability Ternary Classification using Neural Networks and Rigidity Analysis

Discerning how a mutation affects the stability of a protein is central to the study of a wide range of diseases. Machine learning and statistical analysis techniques can inform how to allocate limited resources to the considerable time and cost associated with wet lab mutagenesis experiments. In this work we explore the effectiveness of predicting the change in the stability of a protein due to a mutation using a neural network classfier. Assessing the accuracy of our approach is dependent on the use of experimental data about the effects of mutations performed in vitro. Because the experimental data is prone to discrepancies when similar experiments have been performed by multiple laboratories, the use of the data near the juncture of stabilizing and destabilizing mutations is question- able. We address this later problem via a systematic approach in which we explore the use of a three-way classification scheme with stabilizing, destabilizing, and inconclusive labels. For a systematic search of potential classification cutoff values our classfier achieved 68 percent accuracy on ternary classification for cutoff values of -0.6 and 0.7 with a low rate of classifying stabilizing as destabilizing and vice versa.

Neural Network, Classification, protein stability,↗
DOE OSTI2019

Revealing the Effects of the Non-solvent on the Ligand Shell of Nanoparticles and Their Crystallization

When nanoparticles (NPs) are assembled from solution, a common assembly method of choice is either solution destabilization or solvent evaporation technique. The destabilization of the NP solution by non-solvents results in the formation of faceted supercrystals (SCs) while periodic film-like assemblies are typically formed by solvent evaporation. In this article, we reveal the effect of non-solvents in washing, dispersing, and crystallizing NPs. Small angle neutron scattering (SANS) is employed for monitoring the ligand shell of NPs in solutions upon introduction of various non-solvents. The SC crystallization process is traced in situ with small-angle X-ray scattering (SAXS), and the structures of the resulting single-crystalline SCs are examined in detail by mapping the reciprocal space using SAXS and wide-angle X-ray scattering. Our study suggests that the relative miscibility of the non-solvent with solvents and ligands 4111 determines the solvation and thickness of the ligand shell and thereby the resulting structure of SCs. In the early stage of crystallization, truncated octahedral PbS NPs form SCs with face-centered cubic (fcc) symmetry. In the later stage, the fcc symmetry is preserved in the SC formed by larger (5.60 nm) NPs, but the SC assembled from smaller (4.14 nm) NPs undergoes a phase transition into body-centered cubic (bcc) lattice via Bain transformation, becoming a polycrystalline SC containing three structurally correlated bcc domains and one untransformed fcc domain. Our study provides the detailed understanding of the non-solvent effect that impacts beyond the formation of SCs, enabling the judicious selection of solvent/non-solvent mixtures for NP purification.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Atomistic Conversion Reaction Mechanism of WO 3 in Secondary Ion Batteries of Li, Na, and Ca

Abstract Intercalation and conversion are two fundamental chemical processes for battery materials in response to ion insertion. The interplay between these two chemical processes has never been directly seen and understood at atomic scale. Here, using in situ HRTEM, we captured the atomistic conversion reaction processes during Li, Na, Ca insertion into a WO 3 single crystal model electrode. An intercalation step prior to conversion is explicitly revealed at atomic scale for the first time for Li, Na, Ca. Nanoscale diffraction and ab initio molecular dynamic simulations revealed that after intercalation, the inserted ion–oxygen bond formation destabilizes the transition‐metal framework which gradually shrinks, distorts and finally collapses to an amorphous W and M x O (M=Li, Na, Ca) composite structure. This study provides a full atomistic picture of the transition from intercalation to conversion, which is of essential importance for both secondary ion batteries and electrochromic devices.

He, Yang↗
DOE OSTI2019

The Nature of Hydrogen Adsorption on Platinum in the Aqueous Phase

H2 adsorption properties on Pt in aqueous phase was determined by a reaction kinetic measurement of gas H2 reacting with liquid D2O into liquid HDO, gas HD and D2, and a DFT based ab inito molecular dynamic simulation of H2 adsorption on Pt (111) in the presence and absence of water. Both approaches show that the H2 adsorption on Pt in water is much weaker than that in the gas phase. The presence of interfacial water destabilizes the adsorbed H on Pt via decreasing the adsorption heat (hydrogen binding energy) by 19 - 22 kJ·molH2-1 and inducing an extra entropy loss of 50 - 70 J·mol H2-1·K-1. Upon H adsorption on Pt, the closest water layer near Pt surface shifts to a larger distance from the surface and re-orientates to a more ordered structure; in turn, the water layer limits the translation mobility of adsorbed H on Pt. The influence of interfacial water property on H2 adsorption is also reflected by the decrease of adsorption heat with the decrease of local pH provided by the support. Research was funded by the Laboratory Directed Research and Development program at Pacific Northwest National Laboratory.

Yang, Guoju↗
DOE OSTI2017

The Millennial model: in search of measurable pools and transformations for modeling soil carbon in the new century

Soil organic carbon (SOC) can be defined by measurable chemical and physical pools, such as mineral-associated carbon, carbon physically entrapped in aggregates, dissolved carbon, and fragments of plant detritus. Yet, most soil models use conceptual rather than measurable SOC pools. What would the traditional pool-based soil model look like if it were built today, reflecting the latest understanding of biological, chemical, and physical transformations in soils? We propose a conceptual model-the Millennial model-that defines pools as measurable entities. First, we discuss relevant pool definitions conceptually and in terms of the measurements that can be used to quantify pool size, formation, and destabilization. Then, we develop a numerical model following the Millennial model conceptual framework to evaluate against the Century model, a widely-used standard for estimating SOC stocks across space and through time. The Millennial model predicts qualitatively similar changes in total SOC in response to single factor perturbations when compared to Century, but different responses to multiple factor perturbations. We review important conceptual and behavioral differences between the Millennial and Century modeling approaches, and the field and lab measurements needed to constrain parameter values. We propose the Millennial model as a simple but comprehensive framework to model SOC pools and guide measurements for further model development.

decomposition↗
DOE OSTI2015

Stability and phase transition of localized modes in Bose–Einstein condensates with both two- and three-body interactions

We investigate the stability and phase transition of localized modes in Bose–Einstein Condensates (BECs) in an optical lattice with the discrete nonlinear Schrödinger model by considering both two- and three-body interactions. We find that there are three types of localized modes, bright discrete breather (DB), discrete kink (DK), and multi-breather (MUB). Moreover, both two- and three-body on-site repulsive interactions can stabilize DB, while on-site attractive three-body interactions destabilize it. There is a critical value for the three-body interaction with which both DK and MUB become the most stable ones. We give analytically the energy thresholds for the destabilization of localized states and find that they are unstable (stable) when the total energy of the system is higher (lower) than the thresholds. The stability and dynamics characters of DB and MUB are general for extended lattice systems. Our result is useful for the blocking, filtering, and transfer of the norm in nonlinear lattices for BECs with both two- and three-body interactions.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗