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DOE OSTI2015

Wave-particle dynamics of waveform and defect evolutions in undulated nonlinear self-excited dust acoustic waves

The wave-particle dynamics for the evolutions of defects and surrounding pitchfork type waveforms of a weakly disordered self-excited dust acoustic wave is experimentally investigated in an rf dusty plasma system. Particle trajectories are tracked and correlated with waveform evolution to construct an Eulerian-Lagrangian wave-particle dynamical picture. It is found that the local accumulation and depletion of particles in the wave crest and rear, respectively, determines the local crest speed, and the growth and decay of the local crest height, which in turn determine the waveform evolution. The local crest height and the focusing and defocusing of particle trajectories due to the transverse force fields from the tilted wave crest and the non-uniform crest height along the wave crest are the key factors to determine the above particle accumulation and depletion. It explains the observations such as the lower speed of smaller crests, the straightening of the leading front of the pitchfork waveform associated with the transverse motion of defect to the open side, and the vertical defect gliding in the wave frame through the detachment of the strongly kinked pitchfork branch followed by its reconnection with the trailing crest.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2016

Strongly coupled fluid-particle flows in vertical channels. I. Reynolds-averaged two-phase turbulence statistics

Simulations of strongly coupled (i.e., high-mass-loading) fluid-particle flows in vertical channels are performed with the purpose of understanding the fundamental physics of wall-bounded multiphase turbulence. The exact Reynolds-averaged (RA) equations for high-mass-loading suspensions are presented, and the unclosed terms that are retained in the context of fully developed channel flow are evaluated in an Eulerian–Lagrangian (EL) framework for the first time. A key distinction between the RA formulation presented in the current work and previous derivations of multiphase turbulence models is the partitioning of the particle velocity fluctuations into spatially correlated and uncorrelated components, used to define the components of the particle-phase turbulent kinetic energy (TKE) and granular temperature, respectively. The adaptive spatial filtering technique developed in our previous work for homogeneous flows [J. Capecelatro, O. Desjardins, and R. O. Fox, “Numerical study of collisional particle dynamics in cluster-induced turbulence,” J. Fluid Mech. 747, R2 (2014)] is shown to accurately partition the particle velocity fluctuations at all distances from the wall. Strong segregation in the components of granular energy is observed, with the largest values of particle-phase TKE associated with clusters falling near the channel wall, while maximum granular temperature is observed at the center of the channel. The anisotropy of the Reynolds stresses both near the wall and far away is found to be a crucial component for understanding the distribution of the particle-phase volume fraction. In Part II of this paper, results from the EL simulations are used to validate a multiphase Reynolds-stress turbulence model that correctly predicts the wall-normal distribution of the two-phase turbulence statistics.

42 ENGINEERING↗

NASA NTRS1982

Infrared spectra of protostars - Composition of the dust shells

Nearly complete 2 to 13 micron spectra are presented for 13 compact infrared sources associated with molecular clouds, along with partial spectra of six additional objects. The spectra are found to resemble blackbodies with superposed absorption features from 2.8 to 3.5 microns, at 6.0 and 6.8 microns, and in the silicate band centered near 9.7 microns. Correlations among the features are investigated in an attempt to confirm possible identifications. A good correlation between the deepest part of the absorption at 3.1 microns, its long wavelength wing, and the 6.0 micron features suggests that all may derive from large amorphous water ice particles. The relatively poor correlation between the 3.4 and 6.8 micron optical depths adds no evidence in support of the suggestion that these bands may be due to CH bonds

Willner, S. P.↗

NASA NTRS1985

Environmental Degradation of Materials: Surface Chemistry Related to Stress Corrosion Cracking

Parallel experiments have been performed in order to develop a comprehensive model for stress cracking (SCC) in structural materials. The central objective is to determine the relationship between the activity and selectivity of the microstructure of structural materials to their dissolution kinetics and experimentally measured SCC kinetics. Zinc was chosen as a prototype metal system. The SCC behavior of two oriented single-crystal disks of zinc in a chromic oxide/sodium sulfate solution (Palmerton solution) were determined. It was found that: (1) the dissolution rate is strongly (hkil)-dependent and proportional to the exposure time in the aggressive environment; and (2) a specific slip system is selectively active to dissolution under applied stress and this slip line controls crack initiation and propagation. As a precursor to potential microgrvity experiments, electrophoretic mobility measurements of zinc particles were obtained in solutions of sodium sulfate (0.0033 M) with concentrations of dissolved oxygen from 2 to 8 ppm. The equilibrium distribution of exposed oriented planes as well as their correlation will determine the particle mobility.

Schwarz, J. A.↗

DOE OSTI2025

Compaction and Morphology of Lost Circulation Materials

Lost circulation material (LCM) selection is critical to effectively and efficiently treating wellbore fluid losses in geothermal drilling where costs of treatment can be as much as 30% of the total drilling cost. We conducted several uniaxial compaction experiments on 10 different materials and several material mixtures to identify critical mechanical parameters of each. Materials degraded at 200°C were also investigated to understand how elevated temperatures in geothermal wells would degrade their compaction behavior. Granular materials tended to have lower compressibility and higher compression resistance, while more elongated and softer materials had less mechanical stiffness. Mixing materials tended to moderate the mechanical behaviors while heating universally increased the compaction of materials. Microscopy showed that particle strength tended to correlate positively with roundness and circularity and negatively with elongation of a material. Convexity of the degraded and undegraded materials showed heating may have increased the convexity or roughness of the individual particles. In conclusion, we concluded that granular materials are likely to provide the best seals in wells but that a mixture of size distribution, mechanical rigidity, and elongation is more likely to form a better seal for geothermal wells.

annular pressure drilling↗

DOE OSTI2011

Local field and radiative relaxation rate in a dielectric medium

The effect of macroscopic parameters of a substance on the optical characteristics of impurity particles is investigated. A generalized control equation is derived for two-level emitters forming an ensemble of optical centers in a transparent dielectric medium. In this equation, the effective values of the acting pump field and the radiative relaxation rate of an optical center are taken into account. The formalism developed here is a completely microscopic approach based on the chain of the Bogoliubov-Born-Green-Kirkwood-Yvon equations for reduced density matrices and correlation operators for material particles and modes of a quantized radiation field. The method used here makes it possible to take into account the effects of individual and collective behavior of emitters, which are associated with the presence of an intermediate medium, consistently without using phenomenological procedures. It is shown that the resultant analytic expression for the effective lifetime of the excited state of an optical center conforms with experimental data.

36 MATERIALS SCIENCE↗

DOE OSTI2014

Do interacting coronal mass ejections play a role in solar energetic particle events?

Gradual solar energetic (E > 10 MeV) particle (SEP) events are produced in shocks driven by fast and wide coronal mass ejections (CMEs). With a set of western hemisphere 20 MeV SEP events, we test the possibility that SEP peak intensities, Ip, are enhanced by interactions of their associated CMEs with preceding CMEs (preCMEs) launched during the previous 12 hr. Among SEP events with no, 1, or 2 or more (2+) preCMEs, we find enhanced Ip for the groups with preCMEs, but no differences in TO+TR, the time from CME launch to SEP onset and the time from onset to SEP half-peak Ip. Neither the timings of the preCMEs relative to their associated CMEs nor the preCME widths W {sub pre}, speeds V {sub pre}, or numbers correlate with the SEP Ip values. The 20 MeV Ip of all the preCME groups correlate with the 2 MeV proton background intensities, consistent with a general correlation with possible seed particle populations. Furthermore, the fraction of CMEs with preCMEs also increases with the 2 MeV proton background intensities. This implies that the higher SEP Ip values with preCMEs may not be due primarily to CME interactions, such as the 'twin-CME' scenario, but are explained by a general increase of both background seed particles and more frequent CMEs during times of higher solar activity. This explanation is not supported by our analysis of 2 MeV proton backgrounds in two earlier preCME studies of SEP events, so the relevance of CME interactions for larger SEP event intensities remains unclear.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2015

Investigation of short range charge and spin correlation in Pr{sub 0.67}Ca{sub 0.33}MnO{sub 3} nanoparticles

The particle size effects on charge and spin correlation were studied for Pr{sub 0.67}Ca{sub 0.33}MnO{sub 3}(PCMO) by Electron Paramagnetic Resonance spectroscopy. Magnetization measurements suggests long range charge/orbital ordering (CO/OO) in bulk Pr{sub 0.67}Ca{sub 0.33}MnO{sub 3} at T ∼230 K and antiferromagnetic (AFM) ordering at T∼140K. With the reduction of particle size, CO is suppressed, AFM ordering gives way to ferromagnetic (FM) ordering. We find that with the reduction of particle size in Pr{sub 0.67}Ca{sub 0.33}MnO{sub 3} nanoparticles, the short range correlation in charge and associated spin degrees of freedom also gets suppressed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

NASA NTRS1982

Correlation and prediction of thermophoretic and inertial effects on particle deposition from non-isothermal turbulent boundary layers

The problem of small particle deposition which can cause hot stage corrosion and/or fouling in combustion turbines operating on fuels containing ash or inorganic salts is investigated. Two boundary layer transport phenomena are shown to assume importance in these cases: particle thermophoresis (migration down a temperature gradient) and particle inertia. Thermophoretic and eddy transport across turbulent boundary layers without and with particle inertia effects are quantitatively analyzed. The effects of streamwise blade curvature on particle transport across turbulent boundary layers are determined. It is shown that these phenomena destroy the analogy between mass and heat transfer or mass and momentum transfer. Also studied are the effects on particle deposition of distributed or localized wall blowing, surface roughness, and mainstream turbulence.

Rosner, D. E.↗

NASA NTRS1994

Proton and helium cyclotron anisotropy instability thresholds in the magnetosheath

Both the protons and the helium ions of the terrestrial magnetosheath typically display T (sub perpendicular) greater than T (sub parallel), where perpendicular to and parallel to denote directions perpendicular and parallel to the background magnetic field. Observations of the highly compressed magnetosheath show an inverse correlation between these ion temperature anisotropies and the parallel proton beta. Computer simulations have demonstrated that these correlations are due to wave-particle scattering by electromagnetic ion cyclotron anisotropy instabilities. These correlations correspond to linear theory thresholds of the proton cyclotron and the helium cyclotron instabilities. This paper uses linear Vlasov theory and the assumption of a constant maximum growth rate to obtain closed-form expressions for these thresholds as a function of the relative helium density and the parallel proton beta in a parameter model of the magnetosheath.

Gary, S. Peter↗

NASA NTRS2000

Interactive Soil Dust Aerosol Model in the GISS GCM: Sensitivity of the Soil Dust Cycle to Radiative Properties of Soil Dust Aerosols - Part 1

The sensitivity of the soil dust aerosol cycle to the radiative forcing by soil dust aerosols is studied. Four experiments with the NASA/GISS atmospheric general circulation model, which includes a soil dust aerosol model, are compared, all using a prescribed climatological sea surface temperature as lower boundary condition. In one experiment, dust is included as dynamic tracer only (without interacting with radiation), whereas dust interacts with radiation in the other simulations. Although the single scattering albedo of dust particles is prescribed to be globally uniform in the experiments with radiatively active dust, a different single scattering albedo is used in those experiments to estimate whether regional variations in dust optical properties, corresponding to variations in mineralogical composition among different source regions, are important for the soil dust cycle and the climate state. On a global scale, the radiative forcing by dust generally causes a reduction in the atmospheric dust load corresponding to a decreased dust source flux. That is, there is a negative feedback in the climate system due to the radiative effect of dust. The dust source flux and its changes were analyzed in more detail for the main dust source regions. This analysis shows that the reduction varies both with the season and with the single scattering albedo of the dust particles. By examining the correlation with the surface wind, it was found that the dust emission from the Saharan/Sahelian source region and from the Arabian peninsula, along with the sensitivity of the emission to the single scattering albedo of dust particles, are related to large scale circulation patterns, in particular to the trade winds during Northern Hemisphere winter and to the Indian monsoon circulation during summer. In the other regions, such relations to the large scale circulation were not found. There, the dependence of dust deflation to radiative forcing by dust particles is probably dominated by physical processes with short time scales. The experiments show that dust radiative forcing can lead to significant changes both in the soil dust cycle and in the climate state. To estimate dust concentration and radiative forcing by dust more accurately, dust size distributions and dust single scattering albedo in the model should be a function of the source region, because dust concentration and climate response to dust radiative forcing are sensitive to dust radiative parameters.

Perlwitz, Jan↗

DOE OSTI2024

Application of advanced causal analyses to identify processes governing secondary organic aerosols

Abstract Understanding how different physical and chemical atmospheric processes affect the formation of fine particles has been a persistent challenge. Inferring causal relations between the various measured features affecting the formation of secondary organic aerosol (SOA) particles is complicated since correlations between variables do not necessarily imply causality. Here, we apply a state-of-the-art information transfer measure coupled with the Koopman operator framework to infer causal relations between isoprene epoxydiol SOA (IEPOX-SOA) and different chemistry and meteorological variables derived from detailed regional model predictions over the Amazon rainforest. IEPOX-SOA represents one of the most complex SOA formation pathways and is formed by the interactions between natural biogenic isoprene emissions and anthropogenic emissions affecting sulfate, acidity and particle water. Since the regional model captures the known relations of IEPOX-SOA with different chemistry and meteorological features, their simulated time series implicitly include their causal relations. We show that our causal model successfully infers the known major causal relations between total particle phase 2-methyl tetrols (the dominant component of IEPOX-SOA over the Amazon) and input features. We provide the first proof of concept that the application of our causal model better identifies causal relations compared to correlation and random forest analyses performed over the same dataset. Our work has tremendous implications, as our methodology of causal discovery could be used to identify unknown processes and features affecting fine particles and atmospheric chemistry in the Earth’s atmosphere.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2021

Computational fluid dynamics modeling and analysis of silica nanoparticle synthesis in a flame spray pyrolysis reactor

Flame Spray Pyrolysis (FSP) is a method for large-scale production of nanoparticles and nanoscale powders employed in a wide range of industrial applications. Particle size and morphology are complex functions of the physicochemical phenomena occurring in the FSP reactor. An extensive study of FSP-related phenomena can be utilized to develop effective strategies for achieving desired particle size/morphology and scaling up the overall yield of an FSP system. In this work, a computational fluid dynamics (CFD) model of an FSP reactor is developed to simulate the coupling of key phenomena involved in the particle synthesis process: liquid spray breakup and evaporation, mixing, combustion, and particle formation/growth of silica nanoparticles. Herein, the particle sizes and their distributions from the CFD simulations are validated against experimental data. Subsequently, the simulations are utilized to investigate the impact of process parameters on the resultant flame dynamics and particle growth. Firstly, the CFD results show that the particle sizes are strongly correlated with the precursor concentration in the solvent. At lower precursor concentrations, the spread of the distribution is relatively insensitive to the value of the concentration. At higher concentrations, the spread is higher as the collision probability between particles is higher. Secondly, increasing the pilot flow rate increases the length of the pilot flames impacting the local ignition location of the spray flame. Lastly, it is shown that the dispersion gas flow rate strongly influences the spray flame shape. This shape can be used for control of particle growth as it helps determine the regions of high temperature and the residence time of the particles in the high temperature region enabling the design and process optimization of the FSP reactor.

42 ENGINEERING↗

NASA NTRS1973

Invalidity of standard perturbation techniques in cosmic ray transport theory

It is contended that the existence of particles with arbitrarily long correlation times invalidates the condition necessary for the applicability of standard perturbation techniques in cosmic ray transport theory. It is also argued that Klimas and Sandri's (1971) conclusion about a non-Markovian time development of the particle distribution is unwarranted.

Kaiser, T. B.↗

DOE OSTI2015

Structural and magnetic characterization of electro-crystallized magnetite nanoparticles under constant current

Graphical abstract: Structural and magnetic properties of electro-crystallized magnetite nanoparticles under constant current were studied. All samples were characterized using XRD, SEM, VSM, and Mössbauer spectrometry. - Highlights: • The effect of applied current on morphology and properties of Fe{sub 3}O{sub 4} is studied. • The particle size and morphology are controllable by adjusting the current. • The magnetization depends on particle size, type of surfactant and applied current. • The clear correlation between magnetization and the mean particle size is observed. - Abstract: The effect of applied current on the morphology, particle size, structure, and magnetic properties of magnetite nanoparticles prepared by electro-crystallization method was studied. The synthesis was performed in an electrochemical cell containing two iron electrodes and an aqueous solution of sodium sulfate, and either thiourea, sodium butanoate, or β-cyclodextrine as organic stabilizer. All the samples were characterized by XRD, SEM, VSM, and Mössbauer spectroscopy. X-ray diffraction patterns, clearly confirmed that all products have the cubic spinel Fe{sub 3}O{sub 4} crystal structure. Electron microscope images of the samples showed that their mean particle size is in the range 20–80 nm, and depends critically on the applied current and type of the organic additives. Specific magnetization of the samples at room temperature ranges from 60 to 90 A m{sup 2} kg{sup −1}, depending on the growth conditions. Room temperature Mössbauer spectra are typical of nonstoichiometric Fe{sub 3−δ}O{sub 4}, with a small excess of Fe{sup 3+}, 0.06 ≤ δ ≤ 0.17.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

DOE OSTI2016

Aggregation Kinetics of Hematite Particles in the Presence of Outer Membrane Cytochrome OmcA of Shewanella oneidenesis MR-1

The aggregation behavior of 9, 36, and 112 nm hematite particles was studied in the presence of OmcA, a bacterial extracellular protein, in aqueous dispersions at pH 5.7 through time-resolved dynamic light scattering, electrophoretic mobility, and circular dichroism spectra, respectively. At low salt concentration, the attachment efficiencies of hematite particles in all sizes first increased, then decreased, and finally remained stable with the increase of OmcA concentration, indicating the dominant interparticle interaction changed along with the increase in the protein-to-particle ratio. Nevertheless, at high salt concentration, the attachment efficiencies of all hematite samples gradually decreased with increasing OmcA concentration, which can be attributed to increasing steric force. Additionally, the aggregation behavior of OmcA-hematite conjugates was more correlated to total particle-surface area than primary particle size. It was further established that OmcA could stabilize hematite nanoparticles more efficiently than bovine serum albumin (BSA), a model plasma protein, due to the higher affinity of OmcA to hematite surface. This study highlighted the effects of particle properties, solution conditions, and protein properties on the complicated aggregation behavior of protein-nanoparticle conjugates in aqueous environments.

59 BASIC BIOLOGICAL SCIENCES↗

DOE OSTI2015

Dynamics and yielding of binary self-suspended nanoparticle fluids

Yielding and flow transitions in bi-disperse suspensions of particles are studied using a model system comprised of self-suspended spherical nanoparticles. An important feature of the materials is that the nanoparticles are uniformly dispersed in the absence of a solvent. Addition of larger particles to a suspension of smaller ones is found to soften the suspensions, and in the limit of large size disparities, completely fluidizes the material. We show that these behaviors coincide with a speeding-up of de-correlation dynamics of all particles in the suspensions and are accompanied by a reduction in the energy dissipated at the yielding transition. We discuss our findings in terms of ligand-mediated jamming and un-jamming of hairy particle suspensions.

Agrawal, Akanksha↗

DOE OSTI2026

Reconstruction of atmospheric neutrinos in DUNE’s horizontal-drift far-detector module

This paper reports on the capabilities in reconstructing and identifying atmospheric neutrino interactions in one of the Deep Underground Neutrino Experiment’s (DUNE) far detector modules, a liquid argon time projection chamber (LArTPC) with horizontal drift (FD-HD) of ionization electrons. The reconstruction is based upon the workflow developed for DUNE’s long-baseline oscillation analysis, with some necessary machine-learning models’ retraining and the addition of features relevant only to atmospheric neutrinos such as the neutrino direction reconstruction. Where relevant, the impact of the detection of the charged particles of the hadronic system is emphasized, and comparisons are carried out between the case when lepton-only information is considered in the reconstruction (as is the case for many neutrino oscillation experiments), versus when all particles identified in the LArTPC were included. Three neutrino direction reconstruction methods have been developed and studied for the atmospheric analyses: using lepton-only information, using all reconstructed particles, and using only correlations from reconstructed hits. The results indicate that incorporating more than just lepton information significantly improves the resolution of both neutrino direction and energy reconstruction. The angle reconstruction algorithms developed in this work result in no strong dependence on particle direction for reconstruction efficiencies or neutrino flavor identification. This comprehensive review of the reconstruction of atmospheric neutrinos in DUNE’s FD-HD LArTPC is the first step towards developing a first neutrino oscillation sensitivity analysis, which will ready DUNE for its first measurements.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗