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NASA NTRS1984

Chaotic ion motion in magnetosonic plasma waves

The motion of test ions in a magnetosonic plasma wave is considered, and the 'stochasticity threshold' of the wave's amplitude for the onset of chaotic motion is estimated. It is shown that for wave amplitudes above the stochasticity threshold, the evolution of an ion distribution can be described by a diffusion equation with a diffusion coefficient D approximately equal to 1/v. Possible applications of this process to ion acceleration in flares and ion beam thermalization are discussed.

Varvoglis, H.↗

NASA NTRS1988

Real-time optical laboratory solution of parabolic differential equations

An optical laboratory matrix-vector processor is used to solve parabolic differential equations (the transient diffusion equation with two space variables and time) by an explicit algorithm. This includes optical matrix-vector nonbase-2 encoded laboratory data, the combination of nonbase-2 and frequency-multiplexed data on such processors, a high-accuracy optical laboratory solution of a partial differential equation, new data partitioning techniques, and a discussion of a multiprocessor optical matrix-vector architecture.

Casasent, David↗

NASA NTRS1994

A Comparison of Metallographic Cooling Rate Methods Used in Meteorites

The primary objective of this study was to test the postulate that cooling rates acquired from metal grains in chondrites are consistent with those from iron meteorites. Both types of metal occur in some Group IAB meteorites, which are mixtures of massive metal with well-developed Widmanstatten structures and chondritic inclusions with dispersed metal grains. The grains have textures and compositions similar to chondritic metal, including negligible P. The meteorites studied show little or no sign of shock reheating and textural evidence indicates that silicates and metal were mixed before Widmanstatten patterns formed during cooling. Cooling rates were obtained by comparing measured to modeled taenite grain or lamellae dimensions and central Ni contents. Modeling entails solving diffusion equations using experimental diffusion coefficients, phase relations, and bulk or local Ni and P contents, taking into account geometry, undercooling, and impingement. There is one set of parameters for grains and another, quite different set for Widmanstatten lamellae, including a factor of 30 difference in diffusion coefficients. Yet cooling rates obtained from Widmanstatten structures and metal grains in chondritic inclusions of the same meteorite are consistent; uncertainties in the best data are +/- 10 K/Ma, equivalent to a factor of 1 +/- 0.25. This agreement implies that the data and models are correct or contain fortuitously offsetting errors, which is quite unlikely. Cooling rates range from 40 K/Ma to 70 K/Ma in IAB meteorites that contain both grains and Widmanstatten structures. Rates based on grains in Ni-poor and Ni-rich meteorites lacking Widmansatten patterns expand the range from 30 K/Ma to perhaps 200 K/Ma. Cooling rates correlate with Ni content; Ni-poor meteorites have slower rates than Ni-rich ones. Evidently, IAB meteorites were radially distributed over greater than 30km in a body with a radius less than 50km. A comparison of the available Ar ages with cooling times inferred from the cooling rates suggests that the parent body cooled more slowly after the metallographic cooling rates were established.

Herpfer, Marc A.↗

NASA NTRS2004

Numerical Simulation of Nanostructure Growth

Nanoscale structures, such as nanowires and carbon nanotubes (CNTs), are often grown in gaseous or plasma environments. Successful growth of these structures is defined by achieving a specified crystallinity or chirality, size or diameter, alignment, etc., which in turn depend on gas mixture ratios. pressure, flow rate, substrate temperature, and other operating conditions. To date, there has not been a rigorous growth model that addresses the specific concerns of crystalline nanowire growth, while demonstrating the correct trends of the processing conditions on growth rates. Most crystal growth models are based on the Burton, Cabrera, and Frank (BCF) method, where adatoms are incorporated into a growing crystal at surface steps or spirals. When the supersaturation of the vapor is high, islands nucleate to form steps, and these steps subsequently spread (grow). The overall bulk growth rate is determined by solving for the evolving motion of the steps. Our approach is to use a phase field model to simulate the growth of finite sized nanowire crystals, linking the free energy equation with the diffusion equation of the adatoms. The phase field method solves for an order parameter that defines the evolving steps in a concentration field. This eliminates the need for explicit front tracking/location, or complicated shadowing routines, both of which can be computationally expensive, particularly in higher dimensions. We will present results demonstrating the effect of process conditions, such as substrate temperature, vapor supersaturation, etc. on the evolving morphologies and overall growth rates of the nanostructures.

Hwang, Helen H.↗

NASA NTRSDate not supplied

Composite Bond Line Measurements Based on A Bayesian Analysis of Flash Thermography Data

For bonded composite materials, an accurate characterization of the adhesive bond line is needed to predict failure modes and fracture toughness. In this paper, bond line thickness was estimated from data obtained using through transmission flash thermography. The forward model that predicts back surface temperature is based on a three layer heat diffusion equation with varying diffusivity and flux boundary conditions. The corresponding inverse problem of estimating bond line thickness from measurement data was solved using a Bayesian approach that assumed Gaussian priors for the bond line thickness and thermal diffusivity of the adherends. Finally, the outputs of the thermography based method were compared to measurements that were collected using a micrometer and ultrasound testing.

Flash thermography↗

NASA NTRSDate not supplied

Composite Bond Line Measurements Based on a Bayesian Analysis of Flash Thermography Data

Flash thermography↗

DOE OSTI2018

An exploration of pressure dynamics using differential equations defined on a fractal geometry

Pressure tests have been used to understand the behavior of naturally fractured reservoirs (NFRs) by establishing parameters such as permeability, connectivity of fractures, system compressibility, fracture network parameters, and others associated with the physical properties of the reservoir. The complex fracture network of a NFR produces anomalous fluid flow, which is shown by the pressure behavior at the well. A plausible model to explain this behavior is to assume that it arises from a fractal fracture system. However, to estimate the parameters that define this fractal fracture system, fluid flow models based on the modification of Darcy’s law are used. On the other hand, in this work, a fractal structure with known fractal dimension: Sierpinski gasket (SG) is proposed. The objective of this work is to solve numerically the diffusion equation on SG, and establish a comparison with flow models used in the oil industry to investigate the fractality assumption. This study is focused on the qualitative behavior of the solution of the diffusion equation defined on a SG supported by the Kigami’s theory of differential equations on fractals.

42 ENGINEERING↗

NASA NTRS1997

The Implicit and Explicit alpha-mu Schemes

Artificial numerical dissipation is an important issue in large Reynolds number computations. In such computations, the artificial dissipation inherent in traditional numerical schemes can overwhelm the physical dissipation and yield inaccurate results on meshes of practical size. In the present work, the space-time conservation element and solution element method is used to construct new and accurate numerical schemes such that artificial numerical dissipation will not overwhelm physical dissipation. Specifically, these schemes have the property that numerical dissipation vanishes when the physical viscosity goes to zero. These new schemes therefore accurately model the physical dissipation even when it is extremely small. The method of space-time conservation element and solution element, currently under development, is a nontraditional numerical method for solving conservation laws. The method is developed on the basis of local and global flux conservation in a space-time domain, in which space and time are treated in a unified manner. Explicit solvers for model and fluid dynamic conservation laws have previously been investigated. In this paper, we introduce a new concept in the design of implicit schemes, and use it to construct two highly accurate solvers for a convection-diffusion equation. The two schemes become identical in the pure convection case, and in the pure diffusion case. The implicit schemes are applicable over the whole Reynolds number range, from purely diffusive equations to purely inviscid (convective) equations. The stability and consistency of the schemes are analyzed, and some numerical results are presented. It is shown that, in the inviscid case, the new schemes become explicit and their amplification factors are identical to those of the Leapfrog scheme. On the other hand, in the pure diffusion case, their principal amplification factor becomes the amplification factor of the Crank-Nicolson scheme. We also construct an explicit solver with the treatment of diffusion being based on that in the implicit solvers. The explicit solver has only a CFL stability limitation on the Courant number, yet it retains the second-order spatial accuracy of the implicit schemes.

Chang, Sin-Chung↗

NASA NTRS1999

Implicit Space-Time Conservation Element and Solution Element Schemes

Artificial numerical dissipation is in important issue in large Reynolds number computations. In such computations, the artificial dissipation inherent in traditional numerical schemes can overwhelm the physical dissipation and yield inaccurate results on meshes of practical size. In the present work, the space-time conservation element and solution element method is used to construct new and accurate implicit numerical schemes such that artificial numerical dissipation will not overwhelm physical dissipation. Specifically, these schemes have the property that numerical dissipation vanishes when the physical viscosity goes to zero. These new schemes therefore accurately model the physical dissipation even when it is extremely small. The new schemes presented are two highly accurate implicit solvers for a convection-diffusion equation. The two schemes become identical in the pure convection case, and in the pure diffusion case. The implicit schemes are applicable over the whole Reynolds number range, from purely diffusive equations to convection-dominated equations with very small viscosity. The stability and consistency of the schemes are analysed, and some numerical results are presented. It is shown that, in the inviscid case, the new schemes become explicit and their amplification factors are identical to those of the Leapfrog scheme. On the other hand, in the pure diffusion case, their principal amplification factor becomes the amplification factor of the Crank-Nicolson scheme.

Chang, Sin-Chung↗

DOE OSTI2017

Basis adaptation and domain decomposition for steady-state partial differential equations with random coefficients

We present a novel approach for solving steady-state stochastic partial differential equations in high-dimensional random parameter space. The proposed approach combines spatial domain decomposition with basis adaptation for each subdomain. The basis adaptation is used to address the curse of dimensionality by constructing an accurate low-dimensional representation of the stochastic PDE solution (probability density function and/or its leading statistical moments) in each subdomain. Restricting the basis adaptation to a specific subdomain affords finding a locally accurate solution. Then, the solutions from all of the subdomains are stitched together to provide a global solution. We support our construction with numerical experiments for a steady-state diffusion equation with a random spatially dependent coefficient. Our results show that accurate global solutions can be obtained with significantly reduced computational costs.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2022

Mass Transport in Membrane Systems: Flow Regime Identification by Fourier Analysis

The numerical calculation of local mass distributions in membrane systems by computational fluid dynamics (CFD) offers indispensable benefits. However, the concept to calculate such distributions in response to separate variations of operation conditions (OCs) makes it difficult to address overall, flow-physics-related questions, which require the consideration of the collective interaction of OCs. It is shown that such understanding-related relationships can be obtained by the analytical solution of the advection–diffusion equation considered. A Fourier series model (FSM) is presented, which provides exact solutions of an advection–diffusion equation for a wide range of OCs. On this basis, a new zeroth-order model is developed, which is very simple and as accurate as the complete FSM for all conditions of practical relevance. Advection-dominated blocked and diffusion-dominated unblocked flow regimes are identified (depending on a Péclet number which compares the flow geometry with a length scale imposed by the flow), which implies relevant requirements for the use of lab results for pilot- and full-scale applications. Analyses reveal the equivalence of variations of OCs, which offers a variety of options to accomplish desired flow regime changes.

Heinz, Stefan (ORCID:0000000248712416)↗

DOE OSTI2019

Development of a Novel Accelerator for Neutron Transport Solution Using the Galerkin Spectral Element Methods (Final Report)

This report summarizes the results of a three-year research project sponsored by the U.S. Department of Energy (DOE) Nuclear Energy University Program (NEUP) to develop and implement advanced acceleration schemes for the DOE NEAMS neutronics code PROTEUSSN. The project team included the University of Massachusetts Lowell, The Ohio State University, University of Michigan, and Argonne National Laboratory. The PROTEUS code is a high-fidelity capable deterministic neutron transport code based on unstructured finite element meshes, which solves the steady-state and transient neutron transport problem using the 2nd-order discrete ordinate method (SN2ND), the method of characteristics (MOC), and the advanced nodal transport method (NODAL). The DSA scheme has been implemented in PROTEUS to speed up SN transport calculations. The existing DSA scheme employs a consistent finite element formulation on the same fine mesh structure as the SN solution While the use of consistent discretizations makes the DSA method effective, it does not necessarily make it efficient because the numerical solution of a discretized elliptic diffusion problem itself can be costly, particularly when the problem size becomes large. We developed a new discontinuous Galerkin (DG) discretization of the diffusion equation, called DG-DSA, which can effectively and efficiently accelerate the SN transport iterations. As compared with the previous work, the novelty of our method is that the diffusion equation is solved on a coarse-mesh grid using the DG methods, and the DG diffusion discretization incorporates local hp adaptation, i.e., local adaptation of mesh size and/or polynomial degree, based on local total cross section (or optical thickness). Therefore, the resulting number of degrees of freedom (DOF) of the DG discretization is much less than the conventional consistent DSA discretizations, and thus DG-DSA can achieve significant improvement in computational efficiency. We implemented this scheme in PROTEUS-SN. In addition, we developed a new stabilization scheme named linear prolongation CMFD (lpCMFD). A novel feature of this scheme is that the conventional flat flux ratio–based scaling approach is replaced with a linear interpolation of the scalar flux differences at the coarse-mesh cell edges between the neutron transport and CMFD calculations. Fourier convergence analysis and numerical results show that lpCMFD is unconditionally stable and more effective than other CMFD based on acceleration schemes such as pCMFD, odCMFD. We also developed a new nonlinear diffusion acceleration scheme for solving neutron transport equations. This scheme, called LR-NDA, employs a local refinement approach on the framework of CMFD by solving a local boundary value problem of the scalar flux on the coarse-mesh structure to replace the piecewise constant scalar flux obtained by CMFD. The refined flux is then used to update the scalar flux in the neutron transport source iteration. It has been demonstrated that that LR-NDA is much more effective and stable than CMFD for a wide range of optical thicknesses. LR-NDA is a local adaptive method, which means LR-NDA does not necessarily require local refinement for all the coarse-mesh cells on the problem domain, i.e., it can be used only for relatively optically thick regions where the standard CMFD scheme would encounter the convergence problem.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

NASA NTRS1976

Laws of effluent dispersion in the steady-state atmospheric surface layer in stable and unstable conditions

The two-dimensional diffusion equation has been solved by an integral method to obtain the distribution of ground-level concentration of an inert effluent emitted from a semi-infinite area source in a steady-state and horizontally homogeneous atmospheric surface layer. Mean wind velocity and eddy diffusivity profiles derived from empirically determined flux-profile relations of Businger et al. (1971) for stable and unstable surface layers were used. It is found that concentration as a function of downwind distance can be described by a simple formula over distances of practical interest in surface layer dispersion. Corresponding results for a cross-wind infinite line source are obtained by simple differentiation. The concentration distribution is completely determined by the friction velocity, the Monin-Obukhov length, the roughness length, and the effluent source strength. The generalization of the integral method needed to obtain accurate solutions of the diffusion equation with the given wind velocity and diffusivity profiles is discussed in an appendix.

Lebedeff, S. A.↗

DOE OSTI2018

SUPG stabilization for the nonconforming virtual element method for advection–diffusion–reaction equations

We present here the design, convergence analysis and numerical investigations of the nonconforming virtual element method with Streamline Upwind/Petrov–Galerkin (VEM-SUPG) stabilization for the numerical resolution of convection–diffusion–reaction problems in the convective-dominated regime. According to the virtual discretization approach, the bilinear form is split as the sum of a consistency and a stability term. The consistency term is given by substituting the functions of the virtual space and their gradients with their polynomial projection in each term of the bilinear form (including the SUPG stabilization term). Polynomial projections can be computed exactly from the degrees of freedom. The stability term is also built from the degrees of freedom by ensuring the correct scalability properties with respect to the mesh size and the equation coefficients. The nonconforming formulation relaxes the continuity conditions at cell interfaces and a weaker regularity condition is considered involving polynomial moments of the solution jumps at cell interface. Optimal convergence properties of the method are proved in a suitable norm, which includes contribution from the advective stabilization terms. Experimental results confirm the theoretical convergence rates.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2022

Divergence of Velocity Fields in Electrochemical Systems

The passage of current through electrochemical systems results in the development of concentration gradients in the electrolytic phase that can be modeled using concentrated solution theory. Application of this theory requires knowledge of three concentration-dependent transport coefficients, which are often taken to be conductivity, diffusion coefficient, and the cation transference number with respect to the solvent velocity. The governing diffusion equation for molar concentration contains two additional terms - the thermodynamic factor which is related to activity of the electrolytic species and the solvent velocity. The main advance in this paper is the derivation of an expression for the divergence of the solvent velocity. Solving this equation requires knowledge of the partial molar volume of the electrolyte. Analogous expressions are derived for the mass average and molar average velocities. These velocities occur naturally in the diffusion equation if concentration is expressed as weight fraction and mole fraction of the electrolytic species, respectively.

diffusion↗

NASA NTRS1995

The second-moment climatology of the GATE rain rate data

The first part of this paper presents the description of the GARP (Global Atmospheric Research Program) Atlantic Tropical Experiment (GATE) 1 rain-rate data and its two-dimensional spectral and correlation characteristics, which has made it possible to accomplish the following: to show the concentration of a significant power along the frequency axis in the spatiotemporal spectra; to detect a diurnal cycle (which has a range of variation of about 3.4-5.4 mm/n) as one of the sources of bias in the rain statistics of satellite data; to study the distinction between the north-south and east-west transport of spatial rain-rate field and character of its anisotropy; to evaluate the scales of the distinction between second-moment estimates associated with ground and satellite samples; and to determine the appropriate spatial and temporal scales of simple linear stochastic models fitted to averaged rain-rate fields. The second part of this paper is devoted to an analysis of the diffusion of the rain rate by establishing a relationship between the parameters of the multivariate autoregressive model and the coefficients of a diffusion equation. This analysis led to the use of rain data to estimate the rain advection velocity as well as other coefficients of the diffusion equation of the corresponding field. The results obtained can be used for comparison with corresponding estimates of other sources of data (satellite, Tropical Oceans Global Atmosphere Coupled Ocean - Atmosphere Response Experiment (TOGA, COARE) or simulated by physical models), for generating multiple samples of any size, for solving the inverse problems of some of the hydrodynamic equations, and in some other areas of rain data analysis and modeling.

Polyak, Ilya↗

DOE OSTI2017

A quasilinear operator retaining magnetic drift effects in tokamak geometry

The interaction of radio frequency waves with charged particles in a magnetized plasma is usually described by the quasilinear operator that was originally formulated by Kennel & Engelmann ( Phys. Fluids , vol. 9, 1966, pp. 2377–2388). In their formulation the plasma is assumed to be homogenous and embedded in a uniform magnetic field. In tokamak plasmas the Kennel–Engelmann operator does not capture the magnetic drifts of the particles that are inherent to the non-uniform magnetic field. To overcome this deficiency a combined drift and gyrokinetic derivation is employed to derive the quasilinear operator for radio frequency heating and current drive in a tokamak with magnetic drifts retained. The derivation requires retaining the magnetic moment to higher order in both the unperturbed and perturbed kinetic equations. The formal prescription for determining the perturbed distribution function then follows a novel procedure in which two non-resonant terms must be evaluated explicitly. The systematic analysis leads to a diffusion equation that is compact and completely expressed in terms of the drift kinetic variables. The equation is not transit averaged, and satisfies the entropy principle, while retaining the full poloidal angle variation without resorting to Fourier decomposition. As the diffusion equation is in physical variables, it can be implemented in any computational code. In the Kennel–Engelmann formalism, the wave–particle resonant delta function is either for the Landau resonance or the Doppler shifted cyclotron resonance. In the combined gyro and drift kinetic approach, a term related to the magnetic drift modifies the resonance condition.

Physics↗

DOE OSTI2018

A quasilinear operator retaining magnetic drift effects in tokamak geometry

The interaction of radio frequency waves with charged particles in a magnetized plasma is usually described by the quasilinear operator that was originally formulated by Kennel and Engelmann (Phys. Fluids vol. 9, 1966, pp. 2377-2388). In their formulation the plasma is assumed to be homogenous and embedded in a uniform magnetic field. In tokamak plasmas the Kennel-Engelmann operator does not capture the magnetic drifts of the particles that are inherent to the non-uniform magnetic field. To overcome this deficiency a combined drift and gyrokinetic derivation is employed to derive the quasilinear operator for radio frequency heating and current drive in a tokamak with magnetic drifts retained. The derivation requires retaining the magnetic moment to higher order in both the unperturbed and perturbed kinetic equations. The formal prescription for determining the perturbed distribution function then follows a novel procedure in which two non-resonant terms must be evaluated explicitly. The systematic analysis leads to a diffusion equation that is compact and completely expressed in terms of the drift kinetic variables. The equation is not transit averaged, and satisfies the entropy principle, while retaining the full poloidal angle variation without resorting to Fourier decomposition. As the diffusion equation is in physical variables, it can be implemented in any computational code. In the Kennel-Engelmann formalism, the wave-particle resonant delta function is either for the Landau resonance or the Doppler shifted cyclotron resonance. In the combined gyro and drift kinetic approach, a term related to the magnetic drift modifies the resonance condition.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗