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At least 55 records · Page 3

Efficient Calibration of Expensive Computational Models

Accounting for uncertainty when calibrating expensive computational models is a common challenge faced by scientists and engineers. Often Bayesian techniques are adopted to estimate a probability density function over the model parameters given noisy empirical data. The methods used to perform this type of probabilistic calibration are computationally prohibitive in that they require a large number of evaluations of the expensive model. In these cases, surrogate modeling -- that is, using a fast-to-evaluate, lower fidelity stand-in for the original computational model -- may be the only option to alleviate this computational burden. However, the upfront cost of generating training data to build a surrogate model can itself be expensive. As such, it is important to be judicious when selecting training points at which the full-fidelity model is evaluated. Here, an active learning approach is proposed that enables efficient selection of training points using approximate samples of the calibrated parameter probability density function. In this way, the training points can be concentrated in regions where the calibration algorithm requires high model accuracy.

active learning↗

Metal interfaces - Adhesive energies and electronic barriers

We report a fully self-consistent calculation of the electron number density, barrier height and adhesive energy as a function of separation in an aluminum-aluminum (100) contact. The local density approximation is used for exchange and correlation. The electron number density and barrier heights are strong functions of the separation. The range of strong chemical bonding is about 0.2 nm.

Ferrante, J.↗

Optimizing the Zeldovich approximation

We have recently learned that the Zeldovich approximation can be successfully used for a far wider range of gravitational instability scenarios than formerly proposed; we study here how to extend this range. In previous work (Coles, Melott and Shandarin 1993, hereafter CMS) we studied the accuracy of several analytic approximations to gravitational clustering in the mildly nonlinear regime. We found that what we called the 'truncated Zeldovich approximation' (TZA) was better than any other (except in one case the ordinary Zeldovich approximation) over a wide range from linear to mildly nonlinear (sigma approximately 3) regimes. TZA was specified by setting Fourier amplitudes equal to zero for all wavenumbers greater than k(sub nl), where k(sub nl) marks the transition to the nonlinear regime. Here, we study the cross correlation of generalized TZA with a group of n-body simulations for three shapes of window function: sharp k-truncation (as in CMS), a tophat in coordinate space, or a Gaussian. We also study the variation in the crosscorrelation as a function of initial truncation scale within each type. We find that k-truncation, which was so much better than other things tried in CMS, is the worst of these three window shapes. We find that a Gaussian window e(exp(-k(exp 2)/2k(exp 2, sub G))) applied to the initial Fourier amplitudes is the best choice. It produces a greatly improved crosscorrelation in those cases which most needed improvement, e.g. those with more small-scale power in the initial conditions. The optimum choice of kG for the Gaussian window is (a somewhat spectrum-dependent) 1 to 1.5 times k(sub nl). Although all three windows produce similar power spectra and density distribution functions after application of the Zeldovich approximation, the agreement of the phases of the Fourier components with the n-body simulation is better for the Gaussian window. We therefore ascribe the success of the best-choice Gaussian window to its superior treatment of phases in the nonlinear regime. We also report on the accuracy of particle positions and velocities produced by TZA.

Melott, Adrian L.↗

Local density maxima - Progenitors of structure

Beginning with a short review of the observational data and of some previous theoretical ideas and numerical simulations, the question is addressed of how the large-scale structure that emerges around local density maxima depends on the nature of the primordial density perturbations field. The density contrast profile around local maxima is given, to a good approximation, by the primordial two-point correlation function. The mean number density of objects of a given core mass is calculated as a function of the primordial power spectrum, p(k). In an open universe, rich clusters should have halos steeper than galactic haloes. The observed structure is found to be consistent with omega-sub-zero less than 1.0 and n = -1.

Hoffman, Y.↗

A kinetic-theory approach to turbulent chemically reacting flows

The paper examines the mathematical and physical foundations for the kinetic theory of reactive turbulent flows, discussing the differences and relation between the kinetic and averaged equations, and comparing some solutions of the kinetic equations obtained by the Green's function method with those obtained by the approximate bimodal method. The kinetic method described consists essentially in constructing the probability density functions of the chemical species on the basis of solutions of the Langevin stochastic equation for the influence of eddies on the behavior of fluid elements. When the kinetic equations are solved for the structure of the diffusion flame established in a shear layer by the bimodal method, discontinuities in gradients of the mean concentrations at the two flame edges appear. This is a consequence of the bimodal approximation of all distribution functions by two dissimilar half-Maxwellian functions, which is a very crude approximation. These discontinuities do not appear when the solutions are constructed by the Green's function method described here.

Chung, P. M.↗

The muscle spindle as a feedback element in muscle control

The muscle spindle, the feedback element in the myotatic (stretch) reflex, is a major contributor to muscular control. Therefore, an accurate description of behavior of the muscle spindle during active contraction of the muscle, as well as during passive stretch, is essential to the understanding of muscle control. Animal experiments were performed in order to obtain the data necessary to model the muscle spindle. Spectral density functions were used to identify a linear approximation of the two types of nerve endings from the spindle. A model reference adaptive control system was used on a hybrid computer to optimize the anatomically defined lumped parameter estimate of the spindle. The derived nonlinear model accurately predicts the behavior of the muscle spindle both during active discharge and during its silent period. This model is used to determine the mechanism employed to control muscle movement.

Andrews, L. T.↗

Cosmological parameters and evolution of the galaxy luminosity function

The relationship between the observed distribution of discrete sources of a flux limited sample, the luminosity function of these sources, and the cosmological model is discussed. It is stressed that some assumptions about the form and evolution of the luminosity function must be made in order to determine the cosmological parameters from the observed distribution of sources. Presented is a method to test the validity of these assumptions using the observations. It is shown how, using higher moments of the observed distribution, one can determine, independently of the cosmological model, all parameters of the luminosity function except those describing evolution of the density and the luminosity of the luminosity function. These methods are applied to the sample of approximately 1000 galaxies recently used by Loh and Spillar to determine a value of the cosmological density parameter Omega approx = 1. It is shown that the assumptions made by Loh and Spillar about the luminosity function are inconsistent with the data, and that a self-consistent treatment of the data indicates a lower value of Omega approx = 0.2 and a flatter luminosity function. It should be noted, however, that incompleteness in the sample could cause a flattening of the luminosity function and lower the calculated value of Omega and that uncertainty in the values of these parameters due to random fluctuations is large.

Caditz, David↗

Cosmological parameters and evolution of the galaxy luminosity function

The relationship between the observed distribution of discrete sources of a flux limited sample, the luminosity function of these sources, and the cosmological model is discussed. It is stressed that some assumptions about the form and evolution of the luminosity function must be made in order to determine the cosmological parameters from the observed distribution of sources. Presented is a method to test the validity of these assumptions using the observations. It is shown how, using higher moments of the observed distribution, one can determine, independently of the cosmological model, all parameters of the luminosity function except those describing evolution of the density and the luminosity of the luminosity function. These methods are applied to the sample of approximately 1000 galaxies recently used by Loh and Spillar to determine a value of the cosmological density parameter Omega approx = 1. It is shown that the assumptions made by Loh and Spillar about the luminosity function are inconsistent with the data, and that a self-consistent treatment of the data indicates a lower value of Omega approx = 0.2 and a flatter luminosity function. It should be noted, however, that incompleteness in the sample could cause a flattening of the luminosity function and lower the calculated value of Omega and that uncertainty in the values of these parameters due to random fluctuations is large.

Caditz, David↗

The correlation function for density perturbations in an expanding universe. IV - The evolution of the correlation function

The evolution of the two-point correlation function for the large-scale distribution of galaxies in an expanding universe is studied on the assumption that the perturbation densities lie in a Gaussian distribution centered on any given mass scale. The perturbations are evolved according to the Friedmann equation, and the correlation function for the resulting distribution of perturbations at the present epoch is calculated. It is found that: (1) the computed correlation function gives a satisfactory fit to the observed function in cosmological models with a density parameter (Omega) of approximately unity, provided that a certain free parameter is suitably adjusted; (2) the power-law slope in the nonlinear regime reflects the initial fluctuation spectrum, provided that the density profile of individual perturbations declines more rapidly than the -2.4 power of distance; and (3) both positive and negative contributions to the correlation function are predicted for cosmological models with Omega less than unity.

Mcclelland, J.↗

Density fluctuations induced by nonlinear Alfven waves

The generation of plasma density fluctuations by nonlinear Alfven waves is considered. Of particular interest is the modification to the 'static approximation', describing the relationship between wave intensity and plasma density, when the Alfven wave packet is rapidly steepening. The study concentrates on a forced wave equation for the plasma density, which yields the static approximation in a select approximnation. An analytic solution to this equation is obtained for a reasonable model of a steeping wave packet. The principal results are: (1) the static approximation should give a surprisingly robust description of the coupling between Alfven wave intensity and plasma density; (2) departures of the plasma density perturbation from the static approximation result are determined by a parameter that is a simple function of the wave amplitude and plasma beta; (3) for rapidly evolving wave packets, the position of maximum density change is displaced from that of maximum wave intensity, and (4) the magnitude of the density fluctuation will not be much different than the static approximation estimate.

Spangler, Steven R.↗

The effects of microcracking on the thermal expansion of graphite-epoxy composites

A study of the effects of thermal environment and microcracking in graphite epoxy composites was made. Research indicates that microcracking does affect the thermal expansion of composite laminates. The amount of reduction in thermal expansion was a function of the crack density. A maximum reduction of approximately 25% occurred in a quasi-isotropic specimen with a crack density of 2.05 mm 1 in the 90 deg plies. Laminate analysis with appropriate reductions in E sub 2 and Alpha sub 2 of the damaged plies appears to be capable of modeling the observed

Bowles, D. E.↗

Surface fitting with biharmonic and harmonic models

The physical and geometric interpretation of a surface fitting technique, multiquadric equations (MQ), is discussed. The relation of this method and its reciprocal form to biharmonic and harmonic techniques respectively, is pointed out. In both forms the solutions may be viewed as being numerical approximations of an integral equation in which an unknown density function is the physical source for disturbing potential (reciprocal-MQ) or elastic displacement (MQ).

Hardy, R. L.↗

A numerical study of the effects of ambipolar diffusion on the collapse of magnetic gas clouds

The gravitational collapse of isothermal, nonrotating magnetic gas clouds have been calculated numerically, including the effects of ambipolar diffusion. The fractional ionization in the clouds is approximated by a power-law function of the gas density, f = K/n to the q-power, where K and q are adjustable parameters. Eleven numerical experiments were run, and the results indicate that the asymptotic character of collapse is determined mainly by the value of q and is largely independent of the other parameters characterizing a cloud (e.g., K, cloud mass). In particular, there is nearly a one-to-one correspondence between q and the slope, x, of the central magnetic field strength-gas density relationship. If q is no more than 0.8, a cloud collapses asymptotically, as though the magnetic field were 'frozen' to the neutral matter. The magnetic field strength at the center of a collapsing cloud is strongly amplified during collapse even for values of q of about 1, despite extremely low values of fractional ionization. A discussion of the theoretical basis for this unexpected behavior is given. Possible implications of our results for the problems of magnetic braking of rotating protostars and star formation in general are also presented.

Black, D. C.↗

Equilibrium models of self-gravitating inviscid disks resulting from the collapse of rotating clouds

A method is presented for the construction of velocity and surface density profiles of infinitely thin, self-gravitating disks formed from the collapse of spherical clouds, under the condition that the angular momentum of each material parcel is conserved. Results are presented for initially uniformly rotating clouds with density distributions varying as R exp -n and n = 0, 1, 2. The resulting disk surface density distributions are well represented by power laws in the cylindrical radius over most of their extent. The form of the zeroth-order approximation provides a useful representation of the final surface density function near the center for all three cases, and for n = 2 this result holds throughout the disk. This result is not generally true for the velocity functions, however.

Stemwedel, Sally W.↗