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At least 163 records · Page 9

The spatially nonuniform convergence of the numerical solution of flows

The spatial distribution of the numerical disturbances that are generated during the numerical solution of a flow is examined. It is shown that the distribution of the disturbances is not uniform. In regions where the structure of a flow is simple, the magnitude of the generated disturbances is small and their decay is fast. However, in complex flow regions, as in separation and vortical areas, large magnitude disturbances appear and their decay may be very slow. The observed nonuniformity of the numerical disturbances makes possible the reduction of the calculation time by application of what may be called the partial-grid calculation technique, in which a major part of the calculation procedure is applied in selective subregions, where the velocity disturbances are large, and not within the whole grid. This technique is expected to prove beneficial in large-scale calculations such as the flow about complete aircraft configurations at high angle of attack. Also, it has been shown that if the Navier-Stokes equations are written in a generalized coordinate system, then in regions in which the grid is fine, such as near solid boundaries, the norms become infinitesimally small, because in these regions the Jacobian has very large values. Thus, the norms, unless they are unscaled by the Jacobians, reflect only the changes that happen at the outer boundaries of the computation domain, where the value of the Jacobian approaches unity, and not in the whole flow field.

Panaras, Argyris G.↗

The spatially non-uniform convergence of the numerical solutions of flows

The spatial distribution of the numerical disturbances that are generated during the numerical solution of a flow is examined. It is shown that the distribution of the disturbances is not uniform. In regions where the structure of a flow is simple, the magnitudes of the generated disturbances is small and their decay is fast. However, in complex flow regions, as in separation and vortical areas, large magnitude disturbances appear and their decay may be very slow. The observed nonuniformity of the numerical disturbances makes possible the reduction of the calculation time by application of what may be called the partial-grid calculation technique, in which a major part of the calculation procedure is applied in selective subregions, where the velocity disturbances are large, and not within the whole grid. This technique is expected to prove beneficial in large-scale calculations such as the flow about complete aircraft configurations at high angle of attack. Also, it has been shown that if the Navier-Stokes equations are written in a generalized coordinate system, then in regions in which the grid is fine, such as near solid boundaries, the norms become infinitesimally small, because in these regions the Jacobian has very large values. Thus, the norms, unless they are unscaled by the Jacobians, reflect only the changes that happen at the outer boundaries of the computation domain, where the value of the Jacobian approaches unity, and not in the whole flow field.

Panaras, Argyris G.↗

Insights into determining pore size properties of ultrafiltration membranes

The selectivity of porous membranes is often characterized using solute rejection tests, where membranes are challenged with dilute aqueous solutions of neutral solutes at operating conditions that minimize concentration polarization and fouling. In single solute tests, a membrane is challenged with one molecular weight (MW) solute at a time from low to high MW. Since single solute methods are time-intensive, mixed solute tests have become more common, where a mixture of several MW solutes challenges a membrane at once. However, the presence of large solutes in a mixture increases the rejection of smaller solutes. Furthermore, there are no universally accepted operating conditions or standard methods used by membrane manufacturers or researchers for the experiments, leading to difficulty in pore size and pore characteristic comparisons. In this paper, commercial ultrafiltration membranes were challenged with single and mixed solute polyethylene glycol (PEG) and dextran aqueous solutions. First, rejection values determined using total organic carbon (TOC) and high-performance liquid chromatography (HPLC) from single solute filtration experiments are compared. Differences in rejection curves obtained by the two techniques are attributed to solute polydispersity. Mixed solute filtration experiments with binary mixtures of solutes showcased co-solute interactions, which increase with both the size and weight percent of large solute in the mixture. Mixed solute filtration experiments at varying operating conditions (i.e., stir speed and flux) were conducted to determine operating conditions that mitigate co-solute interactions. Stir speed had a minimal effect on co-solute interactions. In contrast, low flux conditions can help minimize co-solute interactions, leading to pore size distributions that closely resemble results observed in single solute filtration using narrowly dispersed solutes. Additionally, at low flux conditions, the predicted membrane pore size distributions utilizing mixed solute experiments with PEG and dextran were similar.

36 MATERIALS SCIENCE↗

Sensing Small Uncrewed Aerial Vehicles with Distributed Radars for Advanced Air Mobility Surveillance

In the context of Advanced and Urban Air Mobility major attention is being reserved to the development of sensing strategies for small Uncrewed Aerial Vehicles (sUAVs) to enable their safe operations in and around urban areas. Such strategies should rely on non-cooperative distributed sensors to strengthen the surveillance solution towards the unreliability of Global Navigation Satellite System (GNSS) positioning information, which is typical for low-altitude-flying platforms in urban regions, and increase the monitored airspace volume. To this aim, this paper proposes a fusion solution for a network of distributed ground-based radars, which can be exploited to not only increase the coverage over large airspace volumes but also improve the overall detectability and traceability of sUAVs by leveraging on multiple views over the same area. The solution exploits a centralized fusion scheme in which measurements collected by each radar are shared with a Fusion Center where Kalman Filtering is exploited to build a unique, fused track. Tests conducted on experimental data collected using two sUAVs as flying targets and three distributed radars showed that the proposed solution can produce an increase in coverage from about 20 % (single radar configuration) to about 80 % of the targets’ flight path, as well as a finer accuracy yielding meter and meter-per-second root mean square error values on position and velocity components.

Federica Vitiello↗

A method for shock determination and classification and Helios observations of fast, intermediate and slow interplanetary shocks

A new method to determine and classify shocks from in situ measurements is developed, using normalized velocities up- and down-stream in a velocity V(sub 1)-V(sub 2) diagram. With this method one can show how the shock solutions vary with different time averages over the data from the up- and down-stream region. For stable fast forward shocks the solutions are confined well in the 1 to 2 region, and for slow shocks most of the solutions are confined in the 3 to 4 region. A candidate for an intermediate shock was observed by Helios and with our method clearly identified. We found perhaps the first shock with parameters in the 2 to 3 region (with C(sub F1) greater than V(sub 1) greater than C(sub I1), and C(sub I2) greater than V(sub 2) greater than C(sub SL2) and a 180 deg rotation of the tangential magnetic field), which is interpreted as an intermediate shock with B(sub perpendicular 1) being less than B(sub perpendicular 2). The different shock solutions are somewhat distributed in the normalized V(sub 1)-V(sub 2) diagram, but only the intermediate shock solutions are consistent with the Rankine-Hugoniot relations for this particular shock. The Mach number M(sub I1) equals 1.067, a figure in good agreement with the Kennel et al. (1989) theoretical values.

Liu, S.↗

Application of the method of lines for solution of the Navier-Stokes equations using nonuniform grid distributions

The method of lines is investigated for the numerical solution of the stream function and velocity form of the Navier-Stokes equations on nonuniform grids. Stiffness characteristics of a linear one-dimensional model equation are examined to establish the feasibility of applying the method to the volicity equation in two dimensions. It is observed that the transformed governing equations in computational domain become stiffer with increasing the number of grid points and the differencing technique affects the stiffness characteristics. The results demonstrate that the method of lines under certain circumstances is highly suitable for the numerical solution of physical problems on domains covered with variable grids.

Tiwari, S. N.↗

Evaluation of truncation error and adaptive grid generation for the transonic full potential flow calculations

The effects of truncation error on the numerical solution of transonic flows using the full potential equation are studied. The effects of adapting grid point distributions to various solution aspects including shock waves is also discussed. A conclusion is that a rapid change of grid spacing is damaging to the accuracy of the flow solution. Therefore, in a solution adaptive grid application an optimal grid is obtained as a tradeoff between the amount of grid refinement and the rate of grid stretching.

Nakamura, S.↗

SWARM: Reimagining scientific workflow management systems in a distributed world

Modern scientific workflows process massive amounts of data from diverse instruments and sensors, leveraging geographically distributed, heterogeneous compute and storage resources—from leadership-class systems to edge devices—connected by high-performance networks. The diversity of resources introduces challenges in harnessing their full potential, with resilience issues arising across applications, system software, networks, storage, and hardware. Today, workflow management systems (WMS) coordinate the execution of computation and data management tasks across target resources. However, WMS’s centralized nature makes them vulnerable to faults and scalability issues that may result in failures of entire computational campaigns. In conclusion, this paper introduces a novel agentic framework for workflow management, fully distributing and decentralizing the WMS functions and modeling them as swarm intelligence agents infused with advanced artificial intelligence solutions and traditional distributed computing algorithms that can make coordinated decisions in the presence of failures of the underlying cyberinfrastructure.

Swarm intelligence↗

A pressurized gas squeeze film journal damper

A lumped parameter model is developed to determine the stiffness and damping characteristics of inherently compensated gas film bearings. The model relies on the average static pressure over a one dimensional strip bearing. Results of the model are compared with known computer solutions for the distributed strip and a two dimensional square bearing. The results for the stiffness agree well with the computer solutions although the model proved to be inadequate for predicting the film damping.

Stiffler, A. K.↗

Departures of the electron energy distribution from a Maxwellian in hydrogen. I - Formulation and solution of the electron kinetic equation. II - Consequences

The problem of calculating the steady-state free-electron energy distribution in a hydrogen gas is considered in order to study departures of that distribution from a Maxwellian at sufficiently low degrees of ionization. A model kinetic equation is formulated and solved analytically for the one-particle electron distribution function in a steady-state partially ionized hydrogen gas, and it is shown that the formal solution can be accurately approximated by using the WKB method. The solutions obtained indicate that the high-energy tail of the distribution is susceptible to distortion by imbalanced inelastic collisions for ionization fractions not exceeding about 0.1 and that such departures from a Maxwellian can lead to significant changes in the collisional excitation and ionization rates of ground-state hydrogen atoms. Expressions for the electron-hydrogen collision rates are derived which explicitly display their dependence on the hydrogen departure coefficients. The results are applied in order to compare self-consistent predictions with those based on the a priori assumption of a Maxwellian distribution for models of the thermal ionization equilibrium of hydrogen in the optically thin limit, spectral-line formation by a gas consisting of two-level atoms, and radiative transfer in finite slabs by a gas of four-level hydrogen atoms.

Shoub, E. C.↗

On the acceleration of charged particles at relativistic shock fronts

The diffusive acceleration of highly relativistic particles at a shock is reconsidered. Using the same physical assumptions as Blandford and Ostriker (1978), but dropping the restriction to nonrelativistic shock velocities, the authors find approximate solutions of the particle kinetic equation by generalizing the diffusion approximation to higher order terms in the anisotropy of the particle distribution. The general solution of the transport equation on either side of the shock is constructed, which involves the solution of an eigenvalue problem. By matching the two solutions at the shock, the spectral index of the resulting power law is found by taking into account a sufficiently large number of eigenfunctions. Low-order truncation corresponds to the standard diffusion approximation and to a somewhat more general method described by Peacock (1981). In addition to the energy spectrum, the method yields the angular distribution of the particles and its spatial dependence.

Kirk, J. G.↗

Fluid and Electrolyte Balance model (FEB)

The effects of various oral input water loads on solute and water distribution throughout the body are presented in the form of a model. The model was a three compartment model; the three compartments being plasma, interstitial fluid and cellular fluid. Sodium, potassium, chloride and urea were the only major solutes considered explicitly. The control of body water and electrolyte distribution was affected via drinking and hormone levels.

Fitzjerrell, D. G.↗

The cosmic-ray source composition

The cosmic-ray source composition is shown to be related to the observed cosmic-ray abundances by a set of linear equations which are valid for either ad hoc path length distributions or quantitative solutions of galactic propagation models. In the limit of no ionization energy loss, this method is exact for all path length distributions and can replace more detailed numerical integrations; it provides a simple way to calculate directly the source composition implied by a particular set of cross sections, observed abundances, and propagation model. This method is used to determine the source abundances of the galactic cosmic rays in a model-independent manner. Compared to a simple exponential, the path length distribution required by observations is deficient in the contributions from short (not greater than 0.5 g/sq cm) paths at energies of a few GeV per nucleon.

Margolis, S. H.↗

Moment distributions around holes in symmetric composite laminates subjected to bending moments

An analytical investigation of the effects of holes on the moment distribution of symmetric composite laminates subjected to bending moments is described. A general, closed-form solution for the moment distribution of an infinite anisotropic plate is derived, and this solution is used to determine stress distributions both on the hole boundary and throughout the plate. Results are presented for several composite laminates that have holes and are subjected to either pure bending or cylindrical bending. Laminates with a circular hole or with an elliptical hole are studied. Laminate moment distributions are discussed, and ply stresses are described.

Prasad, C. B.↗

Intercomparison of Three Continuous Monitoring Systems on Operating Oil and Gas Sites

We compare continuous monitoring systems (CMS) from three different vendors on six operating oil and gas sites in the Appalachian Basin using several months of data. We highlight similarities and differences between the three CMS solutions when deployed in the field and compare their output to concurrent top-down aerial measurements and to site-level bottom-up inventories. Furthermore, we compare vendor-provided emission rate estimates to estimates from an open-source quantification algorithm applied to the raw CMS concentration data. This experimental setup allows us to separate the effect of the sensor platform (i.e., sensor type and arrangement) from the quantification algorithm. We find that 1) localization and quantification estimates rarely agree between the three CMS solutions on short time scales (i.e., 30 min), but temporally aggregated emission rate distributions are similar between solutions, 2) differences in emission rate distributions are generally driven by the quantification algorithm, rather than the sensor platform, 3) agreement between CMS and aerial rate estimates varies by CMS solution but is close to parity when CMS estimates are averaged across solutions, and 4) similar sites with similar bottom-up inventories do not necessarily have similar emission characteristics. These results have important implications for developing measurement-informed inventories and for incorporating CMS-inferred emission characteristics into emission mitigation efforts.

54 ENVIRONMENTAL SCIENCES↗

Distribution of error in least-squares solution of an overdetermined system of linear simultaneous equations

Probability density functions were derived for errors in the evaluation of unknowns by the least squares method in system of nonhomogeneous linear equations. Coefficients of the unknowns were assumed correct and computational precision were also assumed. A vector space was used, with number of dimensions equal to the number of equations. An error vector was defined and assumed to have uniform distribution of orientation throughout the vector space. The density functions are shown to be insensitive to the biasing effects of the source of the system of equations.

Miller, C. D.↗

Impact of solvation on the electronic resonances in uracil

Interactions of low-energy electrons with the DNA and RNA nucleobases are known to form metastable states, known as electronic resonances. In this work, we study electron attachment to solvated uracil, an RNA nucleobase, using the orbital stabilization method at the Equation of Motion-Coupled Cluster for Electron Affinities with Singles and Doubles (EOM-EA-CCSD) level of theory with the Effective Fragment Potential (EFP) solvation method. We benchmarked the approach using multireference methods, as well as by comparing EFP and full quantum calculations. The impact of solvation on the first one particle (1p) shape resonance, formed by electron attachment to the π* LUMO orbital, as well as the first two particle one hole (2p1h) resonance, formed by electron attachment to neutral uracil's π–π* excited state, was investigated. We used molecular dynamics simulations for solvent configurations and applied charge stabilization technique-based biased sampling to procure configurations adequate to cover the entire range of the electron attachment energy distribution. The electron attachment energy in solution is found to be distributed over a wide range of energies, between 4.6 eV to 6.8 eV for the 2p1h resonance, and between −0.1 eV to 2 eV for the 1p resonance. The solvent effects were similar for the two resonances, indicating that the exact electron density of the state is not as important as the solvent configurations. Multireference calculations extended the findings showing that solvation effects are similar for the lowest four resonances, further indicating that the specific solute electron density is not as important, but rather the water configurations play the most important role in solvation effects. Lastly, by comparing bulk solvation to clusters of uracil with a few water molecules around it, we find that the impact of microsolvation is very different from that of bulk solvation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Analytical inversions in remote sensing of particle size distributions. IV - Comparison of Fymat and Box-McKellar solutions in the anomalous diffraction approximation

It is shown that the inverse analytical solutions, provided separately by Fymat and Box-McKellar, for reconstructing particle size distributions from remote spectral transmission measurements under the anomalous diffraction approximation can be derived using a cosine and a sine transform, respectively. Sufficient conditions of validity of the two formulas are established. Their comparison shows that the former solution is preferable to the latter in that it requires less a priori information (knowledge of the particle number density is not needed) and has wider applicability. For gamma-type distributions, and either a real or a complex refractive index, explicit expressions are provided for retrieving the distribution parameters; such expressions are, interestingly, proportional to the geometric area of the polydispersion.

Fymat, A. L.↗