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At least 775 records · Page 43
All sourcesNASA NTRSDOE OSTI
DOE OSTI2026

Strong Effect of Nonpolar Solvent Molecular Structure on CdSe Nanoplatelet Stacking

We report a drastic difference in stacking behavior of oleic acid-stabilized 4-monolayer (4 ML) CdSe nanoplatelets (NPLs) in toluene and methylcyclohexane (MCH), two nonpolar solvents that differ in the conformational flexibility of their molecules. Using liquid cell transmission electron microscopy (TEM) and small angle scattering (SAXS) techniques, we show that NPLs form microns-long ribbons consisting of 4 ML CdSe NPLs in toluene, the solvent widely used to form stable colloidal solutions of a broad range of quasi-spherical nanoparticles. In contrast, 4 ML CdSe NPLs are well dispersed in MCH. The difference in stacking behavior of NPLs in toluene and MCH suggests that the conformational flexibility of the solvent molecules, such as the ability to adopt multiple chair conformations, modulates nanoplatelet interactions. Molecular dynamics (MD) simulations reveal that solvent molecules subtly alter the structure of the organic ligand shell. These solvent-dependent changes propagate to the inorganic core, modulating the degree of CdSe nanoplatelet (NPL) twisting and, consequently, the properties of the nanoparticles. We show that toluene better solvates oleate ligands while MCH induces a bimodal oleate span distribution, which can lead to increased solubility of CdSe NPLs. In addition, the solvent can also influence the inorganic core, which, in turn, can modify the nanoparticle properties. We demonstrate that destabilization of toluene solution containing ribbons of 4 ML CdSe NPLs without CdS shells results in the formation of NPL assemblies with amplified spontaneous emission (ASE) with a low threshold of 14 µJ cm−2 that is comparable with that of CdSe/CdS core/shell NPLs. Our results emphasize that the solvent plays a major role in mediating interactions between NPLs and hence their processability for fabrication of functional structures.

CdSe↗
DOE OSTI2018

Structural insights into lethal contractural syndrome type 3 (LCCS3) caused by a missense mutation of PIP5Kγ

Signaling molecule phosphatidylinositol 4,5-bisphosphate is produced primarily by phosphatidylinositol 4-phosphate 5-kinase (PIP5K). PIP5K is essential for the development of the human neuronal system, which has been exemplified by a recessive genetic disorder, lethal congenital contractural syndrome type 3, caused by a single aspartate-to-asparagine mutation in the kinase domain of PIP5Kγ. So far, the exact role of this aspartate residue has yet to be elucidated. As such, we conducted structural, functional and computational studies on a zebrafish PIP5Kα variant with a mutation at the same site. Compared with the structure of the wild-type (WT) protein in the ATP-bound state, the ATP-associating glycine-rich loop of the mutant protein was severely disordered and the temperature factor of ATP was significantly higher. Both observations suggest a greater degree of disorder of the bound ATP, whereas neither the structure of the catalytic site nor the Km toward ATP was substantially affected by the mutation. Microsecond molecular dynamics simulation revealed that negative charge elimination caused by the mutation destabilized the involved hydrogen bonds and affected key electrostatic interactions in the close proximity of ATP. Taken together, our data indicated that the disease-related aspartate residue is a key node in the interaction network crucial for effective ATP binding. This work provides a paradigm of how a subtle but critical structural perturbation caused by a single mutation at the ATP-binding site abolishes the kinase activity, emphasizing that stabilizing substrate in a productive conformational state is crucial for catalysis.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

Demonstration of sawtooth period control with EC waves in KSTAR plasma

The sawtooth period control in tokamak is important issue in recent years because the sawtooth crash can trigger TM/NTM instabilities and drive plasmas unstable. The control of sawtooth period by the modification of local current profile near the q=1 surface using ECCD has been demonstrated in a number of tokamaks [1, 2] including KSTAR. As a result, developing techniques to control the sawtooth period as a way of controlling the onset of NTM has been an important area of research in recent years [3]. In 2012 KSTAR plasma campaign, the sawtooth period control is carried out by the different deposition position of EC waves across the q=1 surface. The sawtooth period is shortened by on-axis co-ECCD (destabilization), and the stabilization of the sawtooth is also observed by off-axis co-ECCD at outside q=1 surface. In 2013 KSTAR plasma campaign, the sawtooth locking experiment with periodic forcing of 170 GHz EC wave is carried out to control the sawtooth period. The optimal target position which lengthens the sawtooth period is investigated by performing a scan of EC beam deposition position nearby q=1 surface at the toroidal magnetic field of 2.9 T and plasma current of 0.7 MA. The sawtooth locking by the modulated EC beam is successfully demonstrated as in [3-5] with the scan of modulation-frequency and duty-ratio at the low beta (β N ~0.5) plasma. In this paper, the sawteeth behavior by the location of EC beam and the preliminary result of the sawtooth locking experiments in KSTAR will be presented.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2019

Hydrodynamic and Structural Response Modeling of a Prototype Floating Membrane Reservoir System for Pumped Storage Hydropower

Hydrodynamic, computational fluid dynamics, and finite-element modeling were performed for a novel floating membrane reservoir system design for closed-loop pumped storage hydropower application. The conceptual design, which is now protected under an invention disclosure with a patent pending, offers a potential low-cost, low-impact solution to address the high costs, long investment return periods, and environmental disruptions encountered with traditional pumped storage development while offering modularity to enable replication at many locations. Prior to physical tests on a prototype, this paper documents the response analysis and modeling completed to simulate hydraulic and structural performance under different reservoir deployment and alignment arrangements, evaluate system stability, and refine the conceptual design. The results indicate that the excitation frequency from vortex shedding is at least an order of magnitude lower than the water sloshing frequencies in the reservoir, the structural natural frequency of the entire reservoir, and the vibrational frequencies of the side membranes, although excitation frequencies from other sources could cause mechanical resonance under certain conditions. To control destabilizing effects and prevent rocking motion and vibration, the authors conclude that the design could be improved by including a support structure around the floating reservoir, which could also provide floating-membrane containment, improve safety, and facilitate vertical reservoir movement. These conclusions, based on hydrodynamic and structural response modeling, help define specifications for upcoming full-scale prototype construction, deployment, and testing. This study demonstrates standard modeling technique application to an innovative design for which similar applications have not been previously evaluated. As a result, the refined design is capable of improving the scalability and feasibility of pumped storage hydropower in the United States and will be considered for commercialization following prototype testing.

13 HYDRO ENERGY↗
DOE OSTI2025

River Dissolved Oxygen Prediction Using Machine Learning Models and Wireless Sensor Measurements

Simultaneous flooding&heat and droughts&heat events can potentially destabilize hydro-meteorological conditions to deteriorate the water quality of Neches River. Machine learning (ML) models utilizing wireless sensor measurements have been applied to predict water quality and optimize various water management strategies. This study aims to develop ML models to predict dissolved oxygen (DO) prediction under various hydro-meteorological conditions and enhance water management decision-making. Wireless sensor measurements of DO, water temperature, sample depth, conductivity, turbidity, and pH, along with discharge from the United States Geological Survey stations, are collected for model inputs at the Pine Island Bayou C749 station (PIB-C749) and Neches River Saltwater Barrier (SWB). Multilayer perceptron neural networks, recurrent neural networks, long short-term memory (LSTM), and bidirectional LSTM (BiLSTM) with and without attention mechanism (AT) are tested to determine the best model, which is applied the rolling forecast method to predict 14-day DO. Traditional and recurrent transfer learning (TL and RTL) methods are adopted to overcome insufficient data at the SWB. The input feature importance analysis using the integrated gradients (IG) algorithm is applied to determine dominant inputs. The results show LSTM-based models are capable handling long sequential data. AT-BiLSTM and RTL-LSTM demonstrate the best performance at the PIB-C749 (RMSE=0.054) and the SWB (RMSE=0.028), respectively. TL and RTL methods significantly improve model performance at the SWB. DO, temperature, and pH show higher importance, consistent with hydrodynamics and water chemistry. Both best models are applied to predict 14-day DO and demonstrate reasonable performance for decision-making. Hydro-meteorological conditions of 2017 flood and 2012 drought events are simulated and reveal that possible hypoxia occurs after flooding due to increasing temperature and turbidity, and DO concentration decreases significantly under heat and drought conditions. In conclusion, LSTM-based models utilizing wireless sensor data can be a timely and effective approach to make appropriate decisions on water resource management.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2011

A magnetospheric energy principle extended to include neutral atmosphere

The problem of ideal magnetohydrodynamic stability of plasmas in a magnetosphere-atmosphere system, in which the unperturbed magnetic field is assumed to be perpendicular to the plasma-atmosphere interface (ionospheric surface), is investigated by means of an extended magnetospheric energy principle. The derivation of the principle and conditions under which it applies to a real terrestrial magnetosphere is given. In the principle, the atmosphere is considered to be a very heavy and compressible gas with finite pressure. A thin ionospheric layer is taken into account as boundary conditions, but energetics within it are neglected. The solid-earth surface is assumed to be a perfectly conducting wall for perturbations. For a perturbation that satisfies either rigid or horizontally free boundary conditions at the plasma-atmosphere interface, the self-adjointness of the force operator is satisfied and an extended magnetospheric energy principle can be developed on the basis of the extended energy principle for fusion plasmas. These two boundary conditions are shown to be realized in the magnetosphere when the ionospheric conductivity is either very large or very small. Whereas in fusion plasmas the perturbed magnetic energy in the vacuum makes a stabilizing contribution to the potential energy, in the magnetosphere the perturbed magnetic energy in the atmosphere makes no such stabilizing contribution. This is due to the difference of the assumed field configurations of the magnetospheric and fusion plasmas. The ionospheric surface makes a destabilizing negative contribution to the potential energy owing to a horizontal plasma displacement on the spherical ionospheric surface. The method is applied to magnetospheric ballooning and interchange instabilities. The existence of a new type of magnetospheric interchange instability is shown and its structure in the magnetosphere-atmosphere system is clarified. Possible consequences of the instabilities and their relevance to magnetospheric physics are discussed.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2011

Off-axis fishbone-like instability and excitation of resistive wall modes in JT-60U and DIII-D

An energetic-particle (EP)-driven ''off-axis-fishbone-like mode (OFM)'' often triggers a resistive wall mode (RWM) in JT-60U and DIII-D devices, preventing long-duration high-{beta}{sub N} discharges. In these experiments, the EPs are energetic ions (70-85 keV) injected by neutral beams to produce high-pressure plasmas. EP-driven bursting events reduce the EP density and the plasma rotation simultaneously. These changes are significant in high-{beta}{sub N} low-rotation plasmas, where the RWM stability is predicted to be strongly influenced by the EP precession drift resonance and by the plasma rotation near the q=2 surface (kinetic effects). Analysis of these effects on stability with a self-consistent perturbation to the mode structure using the MARS-K code showed that the impact of EP losses and rotation drop is sufficient to destabilize the RWM in low-rotation plasmas, when the plasma rotation normalized by Alfven frequency is only a few tenths of a percent near the q=2 surface. The OFM characteristics are very similar in JT-60U and DIII-D, including nonlinear mode evolution. The modes grow initially like a classical fishbone, and then the mode structure becomes strongly distorted. The dynamic response of the OFM to an applied n=1 external field indicates that the mode retains its external kink character. These comparative studies suggest that an energetic particle-driven 'off-axis-fishbone-like mode' is a new EP-driven branch of the external kink mode in wall-stabilized plasmas, analogous to the relationship of the classical fishbone branch to the internal kink mode.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2011

InGaAs/GaAs (110) quantum dot formation via step meandering

InGaAs (110) semiconductor quantum dots (QDs) offer very promising prospects as a material base for a new generation of high-speed spintronic devices, such as single electron transistors for quantum computing. However, the spontaneous formation of InGaAs QDs is prevented by two-dimensional (2D) layer-by-layer growth on singular GaAs (110) substrates. In this work we have studied, by using atomic force microscopy and photoluminescence spectroscopy (PL), the growth of InGaAs/GaAs QDs on GaAs (110) stepped substrates by molecular beam epitaxy (MBE), and the modification of the adatom incorporation kinetics to surface steps in the presence of chemisorbed atomic hydrogen. The as-grown QDs exhibit lateral dimensions below 100 nm and emission peaks in the 1.35-1.37 eV range. It has been found that a step meandering instability derived from the preferential attachment of In adatoms to [110]-step edges relative to [11n]-type steps plays a key role in the destabilization of 2D growth that leads to 3D mound formation on both conventional and H-terminated vicinal substrates. In the latter case, the driving force for 3D growth via step meandering is enhanced by H-induced upward mass transport in addition to the lower energy cost associated with island formation on H-terminated substrates, which results in a high density array of InGaAs/GaAs dots selectively nucleated on the terrace apices with reduced lateral dimensions and improved PL efficiency relative to those of conventional MBE-grown samples.

36 MATERIALS SCIENCE↗
DOE OSTI2011

Alignment of dust particles by ion drag forces in subsonic flows

The role of ion drag forces for the alignment of dust particles is studied for subsonic flows. While alignment by wake-field attraction is a well known mechanism for supersonic flows, it is argued here that ion-scattering forces become more important in subsonic ion flows. A model of non-overlapping collisions is introduced and numerical results are discussed. For typical conditions of dusty plasma experiments, alignment by drag forces is found strong enough to overcome the destabilizing force from Coulomb repulsion between dust particles. It turns out that the major contribution to the horizontal restoring force originates from the transverse momentum transfer, which is usually neglected in ion drag force calculations because of an assumed rotational symmetry of the flow.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2011

Asymmetric tearing mode in the presence of viscosity

The linear stability of the tearing mode (TM) in a plasma column is investigated in the presence of viscosity and finite equilibrium current density gradients (i.e., asymmetries). It is shown that for low {beta}, both effects are essential in order to properly describe the mode behaviour close to marginality. In particular, the theory introduces a critical threshold for the destabilization, such that the perturbation grows only if {Delta}'>{Delta}'{sub cr}. The value of {Delta}'{sub cr} depends on the equilibrium configuration and on the plasma parameters. Most importantly, {Delta}'{sub cr} can take negative values, thus allowing unstable tearing modes for {Delta}' < 0 (even in the absence of bootstrap current).

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2011

Role of Combined NNBI and ICRH Heating in FAST H-mode plasmas

The combination of ICRH+NNBI in FAST allows the generation of fast ion populations with different velocity space anisotropy and radial profiles. These energetic ion populations can excite meso-scale fluctuations with the same characteristics of those expected in reactor conditions and, for this reason, FAST can address a number of important burning plasma physics issues. Numerical simulation and modeling of energetic particle physics are based on the use of transport codes that are iteratively coupled with a bi-dimensional full wave-quasi-linear solver for ICRH, in order to determinate the normalized supra-thermal population pressure ss{sub hot}. The value of ss{sub hot}. as well the energetic particle distribution functions can be used as initial condition for numerical simulation studies, investigating the destabilization and saturation of fast ion driven Alfvenic modes.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2011

The stability of the mesospheric plasma layer

The presence of micron and sub-micron size dust in the Earth's summer mesopause are a possible cause of electron density depletion. Whereas electrons in this weakly ionized and weakly magnetized layer are frozen in the magnetic field, the ions and dust are highly diffusive. This relative drift between the plasma particles will cause a current in the medium. The presence of such a current can destabilize the plasma layer with a growth rate of the order of Alfven frequency. Since required current density for the onset of this instability is on the order of J > or approx. 0.03A/m{sup 2}, it is quite unlikely that such a strong current is present in the mesosphere. However, owing to the prevailing ambiguity of measurements, the existence of such a current is not completely ruled out.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

Trapping induced nonlinear behavior of backward stimulated Raman scattering in multi-speckled laser beams

In inertial confinement fusion experiments, stimulated Raman scattering (SRS) occurs when electron density fluctuations are amplified resonantly by the incident laser beams and scattered light. These beams comprise several thousands of individual laser speckles. We have found in single-speckle studies that electron trapping lowers the threshold intensity for SRS onset to a value below that from linear theory and enhances scattering. The trapping-induced plasma-wave frequency shift leads to wave-front bowing and filamentation processes that saturate SRS and limit scattering within a speckle. With large-scale simulations, we have now examined how laser speckles interact with one another through three-dimensional (3D) particle-in-cell (PIC) simulations of two interacting speckles and 2D PIC simulations of ensembles of laser speckles (hundreds of speckles). Our work shows that kinetic trapping physics also governs the onset and saturation of SRS in ensembles of speckles. Speckles interact in a manner that is nonlinear and nonlocal: An intense speckle can destabilize its neighbors through transport of hot electrons and SRS waves, resulting in enhanced emission of particles and waves that, in turn, act upon the original speckle. In this manner, speckles below threshold when in isolation can be above the threshold in multi-speckled beams under conditions for laser-driven fusion experiments at the National Ignition Facility (NIF) and ensembles of speckles are thus found to collectively lower the SRS onset threshold. Simulations of the hohlraum interior where laser beams overlap show that multi-speckled laser beams at low average intensity (a few times 10{sup 14} W/cm{sup 2}) have correspondingly lower thresholds for enhanced SRS and that the sub-ps bursts of SRS saturate through trapping induced nonlinearities. Because of electron trapping effects, SRS reflectivity grows slowly with average laser intensity. While SRS reflectivity saturates under NIF conditions, SRS hot electron energy increases with increasing laser intensity and may contribute to capsule preheat.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

Drift wave dispersion relation for arbitrarily collisional plasma

The standard local linear analysis of drift waves in a plasma slab is generalized to be valid for arbitrarily collisional electrons by considering the electrons to be governed by the drift-kinetic equation with a BGK-like (Bhatnagar-Gross-Krook) collision operator. The obtained dispersion relation reduces to that found from collisionless kinetic theory when the collision frequency is zero. Electron temperature fluctuations must be retained in the standard fluid analysis in order to obtain good quantitative agreement with our general solution in the highly collisional limit. Any discrepancies between the fluid solution and our general solution in this limit are attributed to the limitations of the BGK collision operator. The maximum growth rates in both the collisional and collisionless limits are comparable and are both on the order of the fundamental drift wave frequency. The main role of the destabilizing mechanism is found to be in determining the parallel wave number at which the maximum growth rate will occur. The parallel wave number corresponding to the maximum growth rate is set by the wave-particle resonance condition in the collisionless limit and transitions to being set by the real frequency being on the order of the rate for electrons to diffuse a parallel wavelength in the collisional limit.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

Aspect ratio effects on neoclassical tearing modes from comparison between DIII-D and National Spherical Torus Experiment

Neoclassical tearing mode islands are sustained by helically perturbed bootstrap currents arising at finite beta from toroidal effects that trap a fraction of the particles in non-circulating orbits. DIII-D and NSTX are here operated with similar shape and cross-sectional area but almost a factor of two difference in inverse aspect ratio a/R. In these experiments, destabilized n=1 tearing modes were self-stabilized (reached the 'marginal point') by reducing neutral-beam power and thus beta. The measure of the marginal island gives information on the small-island stabilizing physics that in part (with seeding) governs onset. The marginal island width on NSTX is found to be about three times the ion banana width and agrees with that measured in DIII-D, except for DIII-D modes closer to the magnetic axis, which are about two times the ion banana width. There is a balance of the helically perturbed bootstrap term with small island effects with the sum of the classical and curvature terms in the modified Rutherford equation for tearing-mode stability at the experimental marginal point. Empirical evaluation of this sum indicates that while the stabilizing effect of the curvature term is negligible in DIII-D, it is important in NSTX. The mode temporal behavior from the start of neutral-beam injection reduction also suggests that NSTX operates closer to marginal classical tearing stability; this explains why there is little hysteresis in beta between mode onset, saturation, and self-stabilization (while DIII-D has large hysteresis in beta). NIMROD code module component calculations based on DIII-D and NSTX reconstructed experimental equilibria are used to diagnose and confirm the relative importance of the stabilizing curvature effect, an advantage for low aspect ratio; the relatively greater curvature effect makes for less susceptibility to NTM onset even if the classical tearing stability index is near marginal.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

Linear and nonlinear studies of velocity shear driven three dimensional electron-magnetohydrodynamics instability

The study of electron velocity shear driven instability in electron magnetohydrodynamics (EMHD) regime in three dimensions has been carried out. It is well known that the instability is non-local in the plane defined by the flow direction and that of the shear, which is the usual Kelvin-Helmholtz mode, often termed as the sausage mode in the context of EMHD. On the other hand, a local instability with perturbations in the plane defined by the shear and the magnetic field direction exists which is termed as kink mode. The interplay of these two modes for simple sheared flow case as well as that when an external magnetic field exists has been studied extensively in the present manuscript in both linear and nonlinear regimes. Finally, these instability processes have been investigated for the exact 2D dipole solutions of EMHD equations [M. B. Isichenko and A. N. Marnachev, Sov. Phys. JETP 66, 702 (1987)] for which the electron flow velocity is sheared. It has been shown that dipoles are very robust and stable against the sausage mode as the unstable wavelengths are typically longer than the dipole size. However, we observe that they do get destabilized by the local kink mode.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

Stability of the electron-driven fishbone mode

Electron-driven fishbones provide a good test bed for the linear theory of fast-particle driven instabilities as they exhibit a very high sensitivity to the details of both the equilibrium and the electronic distribution function. Thus, they can help validate the models developed for studying instabilities driven by alpha particles in future fusion reactors such as ITER. The fishbone dispersion relation is extended to properly account for resonance with passing particles by including the contribution of the parallel motion to the resonance condition. Barely passing electrons are found to drive the mode unstable at a lower frequency than barely trapped electrons. Although globally destabilizing, the influence of passing electrons quickly decreases away from the trapped-passing boundary. This is confirmed by an analysis using distributions close to those obtained in electron cyclotron resonance heating experiments. The major effect of this new resonance condition is a reduction of the fast-electron density threshold coupled to a reduction of the frequency of the mode.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2012

On the existence of Weibel instability in a magnetized plasma. II. Perpendicular wave propagation: The ordinary mode

In a magnetized plasma with a temperature anisotropy T{sub ||}>T{sub Up-Tack} (where || and Up-Tack denote directions with respect to the uniform magnetic field B{sub 0}), the nonresonant Weibel instability can develop and destabilize purely growing, ordinary plasma modes (k=k{sub Up-Tack }). This paper presents a rigorous extended analysis of this instability on the basis of a new threshold b{sub 0}(k), which enables to determine the instability conditions as well as the upper limits of the growth rates. Accurate analytical forms of the threshold conditions are provided here for the first time and for the full physical range of the temperature anisotropy and the parallel plasma beta. The marginal and threshold conditions for the plasma parameters, which directly lead to an instability of the ordinary mode, are explicitly derived numerically and analytically. The new analytical tools developed here provide premises for a comprehensive investigation of the interplay of this instability with the firehose instability, as they both can develop in the same conditions.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗