Nanoscale Chemical Imaging of Nanoparticles under Real-World Wastewater Treatment Conditions
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This work examines the diffusional growth of discrete phase particles dispersed within a matrix. Engineering materials are microstructurally heterogeneous, and the details of the microstructure determine how well that material performs in a given application. Critical to the development of designing multiphase microstructures with long-term stability is the process of Ostwald ripening. Ripening, or phase coarsening, is a diffusion-limited process which arises in polydisperse multiphase materials. Growth and dissolution occur because fluxes of solute, driven by chemical potential gradients at the interfaces of the dispersed phase material, depend on particle size. The kinetics of these processes are "competitive," dictating that larger particles grow at the expense of smaller ones, overall leading to an increase of the average particle size. The classical treatment of phase coarsening was done by Todes, Lifshitz, and Slyozov, (TLS) in the limit of zero volume fraction, V(sub v), of the dispersed phase. Since the publication of TLS theory there have been numerous investigations, many of which sought to describe the kinetic scaling behavior over a range of volume fractions. Some studies in the literature report that the relative increase in coarsening rate at low (but not zero) volume fractions compared to that / 2 1/ 3 predicted by TLS is proportional to V(sub v)(exp 1/2), whereas others suggest V(sub v)(exp 1/3). This issue has been resolved recently by simulation studies at low volume fractions in three dimensions by members of the Rensselaer/MSFC team.
Predicting launch vehicle unsteady aerodynamic loads due to buffet remains a significant challenge. Current practices for modeling buffet environments involve the development of buffet forcing functions using discrete unsteady pressure measurements acquired during wind-tunnel tests. These practices often result in significant uncertainty in buffet environments for coupled loads analyses due to the complex spatio-temporal nature of the unsteady pressure field and the challenge of its estimation using discrete sensors. Unsteady pressure sensitive paint, on the other hand, can provide unsteady pressure data at a comparatively high spatial density and may overcome the challenge of unsteady pressure field estimation with discrete sensors and lead to improvements in the development of buffet forcing functions. In this paper, comparisons of the fluctuating pressure field are made for the Space Launch System Block 1 cargo launch vehicle measured using unsteady pressure sensitive paint and pressure transducers.
Predicting launch vehicle unsteady aerodynamic loads due to buffet remains a significant challenge. Current practices for modeling buffet environments involve the development of buffet forcing functions using discrete unsteady pressure measurements acquired during wind-tunnel tests. These practices often result in significant uncertainty in buffet environments for coupled loads analyses due to the complex spatio-temporal nature of the unsteady pressure field and the challenge of its estimation using discrete sensors. Unsteady pressure sensitive paint, on the other hand, can provide unsteady pressure data at a comparatively high spatial density and may overcome the challenge of unsteady pressure field estimation with discrete sensors and lead to improvements in the development of buffet forcing functions. In this paper, comparisons of the fluctuating pressure field are made for the Space Launch System Block 1 cargo launch vehicle measured using unsteady pressure sensitive paint and pressure transducers.
Spatial structure occurs in remotely sensed images when the imaged scenes contain discrete objects that are identifiable in that their spectral properties are more homogeneous within than between them and other scene elements. The spatial structure introduced is manifest in statistical measures such as the autocovariance function and variogram associated with the scene, and it is possible to formulate these measures explicitly for scenes composed of simple objects of regular shapes. Digital images result from sensing scenes by an instrument with an associated point spread function (PSF). Since there is averaging over the PSF, the effect, termed regularization, induced in the image data by the instrument will influence the observable autocovariance and variogram functions of the image data. It is shown how the autocovariance or variogram of an image is a composition of the underlying scene covariance convolved with an overlap function, which is itself a convolution of the PSF. The functional form of this relationship provides an analytic basis for scene inference and eventual inversion of scene model parameters from image data.
Predicting launch vehicle unsteady aerodynamic loads due to buffet remains a significant challenge. Current practices for modeling buffet environments involve the development of buffet forcing functions using unsteady pressure measurements acquired during wind-tunnel tests. These practices often result in significant uncertainty in buffet environments for coupled loads analyses due to the complex spatio-temporal nature of the unsteady pressure field and challenge of its estimation using discrete sensors. Unsteady pressure sensitive paint, on the other hand, can provide unsteady pressure data at a comparatively high-spatial-density and may overcome the challenge of unsteady pressure field estimation with discrete sensors and lead to improvements in the development of buffet forcing functions. In this paper, comparisons of the fluctuating pressure field are made for the Space Launch System Block 1 cargo launch vehicle measured using unsteady pressure sensitive paint and pressure transducers.
Here, we present a numerical algorithm that enables a phase-space adaptive Eulerian Vlasov–Fokker–Planck (VFP) simulation of inertial confinement fusion (ICF) capsule implosions. The approach relies on extending a recent mass, momentum, and energy conserving phase-space moving-mesh adaptivity strategy to spherical geometry. In configuration space, we employ a mesh motion partial differential equation (MMPDE) strategy while, in velocity space, the mesh is expanded/contracted and shifted with the plasma’s evolving temperature and drift velocity. The mesh motion is dealt with by transforming the underlying VFP equations into a computational (logical) coordinate, with the resulting inertial terms carefully discretized to ensure conservation. To deal with the spatial and temporally varying dynamics in a spherically imploding system, we have developed a novel nonlinear stabilization strategy for MMPDE in the configuration space. The strategy relies on a nonlinear optimization procedure that optimizes between mesh quality and the volumetric rate change of the mesh to ensure both accuracy and stability of the solution. Implosions of ICF capsules are driven by several boundary conditions: (1) an elastic moving wall boundary; (2) a time-dependent Maxwellian Dirichlet boundary; and (3) a pressure-driven Lagrangian boundary. Of these, the pressure-driven Lagrangian boundary driver is new to our knowledge. The implementation of our strategy is verified through a set of test problems, including the Guderley and Van-Dyke implosion problems — the first-ever reported using a Vlasov–Fokker–Planck model.
Cracking of light alkenes on solid acids and, in particular on zeolites, is ubiquitous in refineries. Different zeolite framework topologies in the catalysts used provide spatial constraints for reactants and products, leading to discrete reaction routes and varying selectivities. The conversion of alkenes in cracking proceeds either via monomolecular or bimolecular reaction pathways. In both routes, the reacting alkene adsorbs first on Brønsted acid sites forming the initial state (e.g., π-complex, carbenium ion or alkoxide), followed by β-cleavage in the carbenium transition state, generating a smaller alkene and a carbenium ion (monomolecular route) or forming a dimer by alkene addition that cracks subsequently (bimolecular route). The current state of understanding alkene sorption and cracking is critically discussed in this paper and four questions are formulated that may be the central questions from our perspective in further developing new generations of catalysts and processes for alkene conversion.
Here we present a realizability-preserving numerical method for solving a spectral two-moment model to simulate the transport of massless, neutral particles interacting with a steady background material moving with relativistic velocities. The model is obtained as the special relativistic limit of a four-momentum-conservative general relativistic two-moment model. Using a maximum-entropy closure, we solve for the Eulerian-frame energy and momentum. The proposed numerical method is designed to preserve moment realizability, which corresponds to moments defined by a nonnegative phase-space density. The realizability-preserving method is achieved with the following key components: (i) a discontinuous Galerkin phase-space discretization with specially constructed numerical fluxes in the spatial and energy dimensions; (ii) a strong stability-preserving implicit-explicit time-integration method; (iii) a realizability-preserving conserved to primitive moment solver; (iv) a realizability-preserving implicit collision solver; and (v) a realizability-enforcing limiter. Component (iii) is necessitated by the closure procedure, which closes higher order moments nonlinearly in terms of primitive moments. The nonlinear conserved to primitive and the implicit collision solves are formulated as fixed-point problems, which are solved with custom iterative solvers designed to preserve the realizability of each iterate. With a series of numerical tests, we demonstrate the accuracy and robustness of this discontinuous-Galerkin-implicit-explicit method.
A conventional articulated rotor blade has mechanical flap and lag hinges, a lag damper, and a pitch bearing. In connection with an interest in designs of greater mechanical simplicity and increased maintainability, hingeless and bearingless rotors have been developed. A hingeless blade lacks the hinges and is cantilevered at the hub. It does have a pitch bearing for pitch control. A bearingless design eliminates the hinges and the pitch bearing as well. In the present investigation of bearingless rotor blade characteristics, finite element analysis has been successfully applied to determine the solutions of the nonlinear trim equations and the linearized flutter equations of multiple-load-path blades. The employed formulation is based on Hamilton's principle. The spatial dependence of the equations of motion is discretized by dividing the flexbeams, the torque tube, and the outboard into a number of elements.
An arrayed hot-film sensor has been developed for use in laminar boundary-layer research for the detection of crossflow or Goertler vortices. This sensor has been developed to detect spatial variations in heat transfer which are characteristic of crossflow or Goertler vortices. The sensor is ultimately intended for flight research applications. This paper describes the sensor, its priciples of operation, signal analysis techniques, and experimental results illustrating the spatial detection capabilities of this specialized hot-film device. Discretely placed spheres placed in the boundary layer created alternating regions of undisturbed and disturbed laminar flow over a prototype sensor. Flow visualization results were correlated with the sensor output to demonstrate the ability of the sensor to determine the spatial boundaries of localized disturbances in laminar flow. This work represents the initial steps toward the validation and calibration of an arrayed hot-film sensor for the detection of crossflow or Goertler vorticity wavelength and/or wave frequency.
An analysis of the present three-dimensional thunderstorm electrical model and its finite-difference approximations indicates unconditional stability for the discretization that results from the approximation of the spatial derivatives by a box-schemelike method and of the temporal derivative by either a backward-difference or Crank-Nicholson scheme. Lightning propagation is treated through numerical techniques based on the inverse-matrix modification formula and Cholesky updates. The model is applied to a storm observed at the Kennedy Space Center in 1978, and numerical comparisons are conducted between the model and the theoretical results obtained by Wilson (1920) and Holzer and Saxon (1952).
The problem of hinged multibody dynamics is solved using an extension of the innovations approach of linear filtering and prediction theory to the problem of mechanical system modeling and control. This approach has been used quite effectively to diagonalize the equations for filtering and prediction for linear state space systems. It has similar advantages in the study of dynamics and control of multibody systems. The innovations approach advanced here consists of expressing the equations of motion in terms of two closely related processes: (1) the innovations process e, a sequence of moments, obtained from the applied moments T by means of a spatially recursive Kalman filter that goes from the tip of the manipulator to its base; (2) a residual process, a sequence of velocities, obtained from the joint-angle velocities by means of an outward smoothing operations. The innovations e and the applied moments T are related by means of the relationships e = (I - L)T and T = (I + K)e. The operation (I - L) is a causal lower triangular matrix which is generated by a spatially recursive Kalman filter and the corresponding discrete-step Riccati equation. Hence, the innovations and the applied moments can be obtained from each other by means of a causal operation which is itself casually invertible.
The estimation of exact displacement and displacement rate feedback kernels from finite dimensional control solutions based on finite element structural models is discussed. These kernels are then transformed to equivalent curvature and curvature rate feedback kernels. These curvature kernels are augmented with single point displacement and rotation feedback to account for rigid body motions. A growing class of sensors known as area-averaging sensors is used to measure the curvature and curvature rate state functions. The output of area-averaging sensors equals the convolution of all structural curvature states with the spatial sensitivity function of the sensors. Transforming the discrete feedback gains into continuous feedback kernels and employing area-averaging sensors make it possible to implement full state feedback for infinite order structural systems.
The formation of the auroral bulge is investigated on the basis of all-sky TV auroral data with high spatial and temporal resolution. Ways in which the discrete auroral structures within the poleward expanding bulge develop systematically toward the west, the east, and also equatorward from a localized breakup region are shown. Auroral structure at the western end of the bulge (a surge) develops with clockwise rotation as viewed along the magnetic field direction. At the eastern part of the bulge, thin auroral features propagate eastward from the breakup region. Around the central meridian of the bulge, auroral features expand equatorward and become north-south aligned (the N-S aurora). The N-S aurora and the eastward propagating aurora develop into diffuse and pulsating aurora after the expansion. It is suggested that these discrete auroral structures in the bulge develop along the plasma streamlines in a localized distorted two-cell equipotential distribution.
The ROSAT all-sky survey and Guest Observer pointed observations have brought a wealth of high-quality data to the study of the soft X-ray diffuse background. Analysis of the spatial structure of the 1/4 keV flux, including observations of shadows cast by discrete clouds in the interstellar medium, have allowed the separation of the observed flux into foreground and background components supporting a spatially varying local component consistent with previous ideas of the local hot bubble, a highly variable galactic halo component, and an extragalactic background.
The spontaneous breakup of a single spiral wave of excitation into a turbulent wave pattern has been observed in both discrete element models and continuous reaction-diffusion models of spatially homogeneous 2D excitable media. These results have attracted considerable interest, since spiral breakup is thought to be an important mechanism of transition from the heart rhythm disturbance ventricular tachycardia to the fatal arrhythmia ventricular fibrillation. It is not known whether this process can occur in the absence of disease-induced spatial heterogeneity of the electrical properties of the ventricular tissue. Candidate mechanisms for spiral breakup in uniform 2D media have emerged, but the physical validity of the mechanisms and their applicability to myocardium require further scrutiny. In this letter, we examine the computer simulation results obtained in two discrete element models and show that the instability of each spiral is an artifact resulting from an unphysical dependence of wave speed on wave front curvature in the medium. We conclude that spiral breakup does not occur in these two models at the specified parameter values and that great care must be exercised in the representation of a continuous excitable medium via discrete elements.
This work examines the diffusional growth of discrete phase particles dispersed within a matrix. Engineering materials are microstructurally heterogeneous, and the details of the microstructure determine how well that material performs in a given application. Critical to the development of designing multiphase microstructures with long-term stability is the process of Ostwald ripening. Ripening, or phase coarsening, is a diffusion-limited process which arises in polydisperse multiphase materials. Growth and dissolution occur because fluxes of solute, driven by chemical potential gradients at the interfaces of the dispersed phase material, depend on particle size. The kinetics of these processes are "competitive," dictating that larger particles grow at the expense of smaller ones, overall leading to an increase of the average particle size. The classical treatment of phase coarsening was done by Todes, Lifshitz, and Slyozov, (TLS) in the limit of zero volume fraction, V(sub v), of the dispersed phase. Since the publication of TLS theory there have been numerous investigations, many of which sought to describe the kinetic scaling behavior over a 0 range of volume fractions. Some studies in the literature report that the relative increase in coarsening rate at low (but not zero) volume fractions compared to that predicted by TLS is proportional to v(sub v)(exp 1/2), whereas others suggcest V(sub v)(exp 1/3). This issue has been resolved recently by simulation studies at low volume fractions in three dimensions by members of the Rensselaer/MSFC team. Our studies of ripening behavior using large-scale numerical simulations suggest that although there are different circumstances which can lead to either scaling law, the most important length scale at low volume fractions is the diffusional analog of the Debye screening length. The numerical simulations we employed exploit the use of a recently developed "snapshot" technique, and identifies the nature of the coarsening dynamics at various volume fractions. Preliminary results of numerical and experimental investigations, focused on the growth of finite particle clusters, provide important insight into the nature of the transition between the two scaling regimes. The companion microgravity experiment centers on the growth within finite particle clusters, and follows the temporal dynamics driving microstructural evolution, using holography.