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At least 217 records · Page 12

A windowed mean trajectory approximation for condensed phase dynamics

We propose a trajectory-based quasi-classical method for approximating dynamics in condensed phase systems. Building upon the previously developed optimized mean trajectory approximation that has been used to compute linear and nonlinear spectra, we borrow some ideas from filtering trajectory methods to obtain a novel semiclassical method for the dynamical propagation of density matrices. This new approximation is tested rigorously against standard multistate electronic models, spin-boson models, and models of the Fenna–Matthews–Olson complex. For dissipative systems, the current method is significantly better or as good as many other semiclassical methods available, especially at low temperatures and for off-diagonal density matrix elements, whereas for scattering models, the current method bears similar limitations as mean-field propagation schemes. All results are tested against the numerically exact hierarchical equations of motion method. In conclusion, the new method shows excellent agreement across various parameter regimes with numerically exact results, highlighting the robustness and accuracy of our approach.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

An analytic approximation to the covariance between pre- and post-reconstruction galaxy two-point statistics

We present a simple analytic approximation for the covariance between pre-reconstruction galaxy power spectrum measurements and post-reconstruction two-point correlation functions. This cross-covariance is essential for joint analyses that combine full-shape clustering information with baryon acoustic oscillation (BAO) measurements, as commonly performed in modern spectroscopic surveys. Our model builds on the disconnected contribution to the covariance and accounts for the damping of correlations due to the BAO reconstruction process. We validate our analytic prescription against numerical simulations from the Dark Energy Spectroscopic Instrument (DESI), testing both idealized cubic geometries and realistic survey configurations including complex footprints and fiber assignment effects. Despite neglecting survey window functions in the analytic calculation, we find excellent agreement with simulation-based covariances and demonstrate that cosmological parameter constraints are virtually unchanged when using our approximation. Our results show that the pre-post cross-covariance is sufficiently small that even approximate treatments are adequate for cosmological inference, opening a pathway toward fully analytic covariance matrices for next-generation galaxy surveys.

baryon acoustic oscillations↗

Power Flow Geometry and Approximation

Here, the power flow equations are important in numerous power systems problems of practical interest which consider alternating current power flow (ACPF) physics. Perhaps the most well studied being the alternating current optimal power flow problem (ACOPF), seeking to optimize the operation of an electric power system. Due to their non-linearity, problems which include the power flow equations are typically challenging, particularly in optimization. Interestingly, the set of solutions to the power flow equations forms a smooth manifold. As a result, differential geometry can be used to describe and analyze this set of equations. This approach has proven effective in several engineering applications (e.g., solving ACOPF and analyzing the solution space boundary). Central to the success of this approach is an understanding of the power flow manifold's geometry. In this work, we develop the geometric and topological properties of this manifold using concepts from differential geometry. After demonstrating the convenience of this manifold's representation as a function's graph, computational methods are emphasized: we develop retractions, error bounds for linear approximation, and formulas for evaluating the Riemannian metric (including associated objects such as geodesics and the curvature tensor). Scalar curvature and the second fundamental form play a new role in quantifying the quality of linear approximations, like the popular direct current approximation. All functions are implemented in Julia and available in an online repository. Proofs are included for completeness.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Extended Galerkin Neural Network Approximation of Singular Variational Problems with Error Control

We present extended Galerkin neural networks, a variational framework for approximating general boundary value problems (BVPs) with error control. The main contributions of this work are (1) a rigorous theory guiding the construction of new weighted least squares variational formulations suitable for use in neural network approximation of general BVPs, and (2) an “extended” feedforward network architecture which incorporates and is even capable of learning singular solution structures, thus greatly improving approximability of singular solutions. Furthermore, numerical results are presented for several problems, including steady Stokes flow around reentrant corners and in convex corners with Moffatt eddies in order to demonstrate efficacy of the method.

a posteriori error estimate↗

Exploring Data Set Bias and Decision Support with Predictive Uncertainty Through Bayesian Approximations and Convolutional Neural Networks

Individual seismic catalogs can contain multiscale observations from fault level to global scales and associated waveforms from discrete events reflect crustal structure across many different scales and locations. Seismic network aperture, geographic location, and observation distance may not provide informative guidance or intuition on how different catalogs will behave across models trained under different conditions. We rely on uncertainty to provide guardrails for when to trust model decisions, but understanding when our uncertainty is trustworthy is an open challenge. Here, in this work, we explore Bayesian approximation methods for assigning predictive uncertainty in seismic event classification problems. We find that computationally expensive Bayesian approximations do not outperform simple ensemble methods. We also find that when exploiting multiple seismic event catalogs, joint training with data from all the catalogs combined with Bayesian approximations and supervised training for classification can obscure bias and result in less robust uncertainty while also not providing substantial performance benefits compared to training individual models for each catalog.

58 GEOSCIENCES↗

Approximate Solutions for the Flow About Flat-Top Wing-Body Configurations at High Supersonic Airspeeds

The flow about slender flat-top wing-body configurations traveling at high supersonic speeds and small angles of attack is investigated analytically. In the case of conical configurations, approximate algebraic solutions to the flow field are obtained. In the case of configurations which are conical at the vertex but curved in the stream direction, these solutions are combined with a slender-body approximation to the generalized shock-expansion method to obtain the flow downstream of the vertex. Surface pressures were obtained experimentally at Mach numbers from 3.0 to 6.0 and angles of attack up to 6 deg for several flat-top wing-body configurations. These configurations consisted of half-bodies of revolution mounted beneath thin highly swept wings. Three different bodies were employed. The two conical bodies consisted of one-half of a fineness-ratio-5 cone and one-half of a fineness-ratio-2-1/2 cone. The body of the third configuration consisted of one-half of a fineness-ratio-5 ogive. For the ogive configuration, the leading edges of the wing were curved and designed to just maintain the theoretically determined bow shock along the leading edge at a Mach number of 5.0 and an angle of attack of 3 deg. The predictions of the conical flow theory of this paper for the surface pressures are found to be in good agreement with experiment at Mach numbers of 5.0 and 6.0 up to angles of attack of approximately 3 deg. Estimated lift, drag, and pitching-moment coefficients, as well as maximum lift-drag ratio, are also in good agreement with existing experimental data at a Mach number of 5.0 for a conical configuration having an arrow plan-form wing. It is also found that the generalized shock-expansion method yields reasonable good agreement with experiment for the surface pressures on the half-ogive configuration at a Mach number of 5.0 and an angle of attack of 3 deg.

Savin, Raymond C.↗

Collisional excitation of the highly excited hydrogen atoms in the dipole form of the semiclassical impact parameter and Born approximations

Expressions for the excitation cross section of the highly excited states of the hydrogenlike atoms by fast charged particles have been derived in the dipole approximation of the semiclassical impact parameter and the Born approximations, making use of a formula for the asymptotic expansion of the oscillator strength of the hydrogenlike atoms given by Menzel. When only the leading term in the asymptotic expansion is retained, the expression for the cross section becomes identical to the expression obtained by the method of the classical collision and correspondence principle given by Percival and Richards. Comparisons are made between the Bethe coefficients obtained here and the Bethe coefficients of the Born approximation for transitions where the Born calculation is available. Satisfactory agreement is obtained only for n yields n + 1 transitions, with n the principal quantum number of the excited state.

Omidvar, K.↗

Nth-order flat approximation of the signum function by a polynomial

In the interval studied, the signum function, sgn x, was demonstrated to be uniquely approximated by an odd polynomial f sub n (x) of order 2n-1, for which the approximation is nth order flat with respect to the points (1,1) and (-1,-1). A theorem was proved which states that for even integers n or = 2, the approximating polynomial has a pair of nonzero real roots + or - x sub n such that the x sub n form a monotonically decreasing sequence which converges to the root of 2 as n approaches infinity. For odd n i, f sub n (x) represents a strictly increasing monotonic function for all real x. As n tends to infinity, f sub n (x) converges to sgn x uniformly in two interval ranges.

Hosenthien, H. H.↗

Study of different approximation in the calculation of g tensors - H2/+/

The theory of the g tensor in one-electron systems is briefly reviewed and calculations are performed in several ways for the hydrogen molecular ion in order to test approximations which must be made for larger systems. Approximate ground state wavefunctions are determined variationally. The first-order wavefunction with respect to the orbit-field perturbation is calculated, and the second-order g tensor is determined. The results of the various approximate calculations are compared and discussed. It is found that the linear combination of atomic orbitals method is rather poor and that two center integrals cannot be neglected.

De Montgolfier, P.↗

Charge-impact excitation of the highly excited hydrogen atoms in the dipole form of the semiclassical impact-parameter and Born approximations.

Derivation of expressions for the excitation cross section in the dipole approximation of the semiclassical impact parameter and the Born approximations, making use of a formula given by Menzel (1968, 1969) for the asymptotic expansion of the oscillator strength of the hydrogen-like atoms. When only the leading term in the asymptotic expansion is retained, the expression for the cross section becomes identical with the expression obtained by the method of the classical collision and correspondence principle given by Percival and Richards (1970). Comparisons are made between the Bethe coefficients obtained by the author and the Bethe coefficients of the Born approximation for transitions where the Born calculation is available. Satisfactory agreement is obtained only for n yields n + 1 transitions, where n is the principal quantum number of the excited state.

Omidvar, K.↗

An approximation to midcourse correction direction errors.

A new approximation to the components of midcourse correction direction errors is described that is more accurate than a previously used approximation. The calculation effort involved is much less than that for numerical integration. A comparison of numerical integration results with those of the new approximation is presented in a diagram.

Kibler, J. F.↗

An approximate method for the synthesis of optimal control of distributed systems.

An approximate method is presented for the synthesis of an optimal control of distributed parameter systems, based on a combination of the ideas of Lyapunov's direct method and those of Bellman's successive approximation in policy space. The method is such that the approximate equation is improved after each iteration in the sense of the performance index being used.

Park, K. E.↗

Method of approximate determination of the characteristics of nonlinear vibrational systems

Methods are discussed for determining the characteristics of elements of nonlinear vibrational systems, from the results of analyzing forced vibrations which are approximate in themselves, since they are based on the use of experimental data. The constant components of the linearized characteristics and linearization coefficients are determined experimentally by finding the values of these quantities at different vibration amplitudes and frequencies and subsequent approximation of their analytical expressions. Simple and convenient, although approximate, formulas for determining the characteristics of vibrational systems from experimentally known functions are derived.

Atstupenene, R. P.↗

Comparison of approximate and numerical analyses of nonlinear combustion instability

At the present time, there are three general analytical techniques available to study problems of unsteady motions in rocket motors: linear stability analysis; approximate nonlinear analysis, founded on examining the behavior of coupled normal modes; and numerical calculations based on the conservation equations for one-dimensional flows. The last two yield the linear results as a limit. It is the main purpose of this paper to check the accuracy of the approximate analysis against the numerical analysis for some special cases. The results provide some justification for using the approximate analysis to study three-dimensional problems.

Culick, F. E. C.↗

Aircraft maneuver optimization of reduced-order approximation

Review of recent work in recasting the energy type of approximation to aircraft flight in terms of singular perturbation theory and in extending this theory to three-dimensional maneuvers. Singular perturbations for differential equations arising in optimal control are first examined for a system of fairly general form but low order. The attitude dynamics for optimal flight of a rocket in vacuum is then studied as an introductory, and fairly transparent, example. The question of the choice of variables is then discussed. Finally, optimal aircraft flight in various reduced-order approximations is investigated. In particular, the problem of three-dimensional aircraft flight is formulated for singular perturbation treatment, and possibilities for decoupling into several lower-order problems are illustrated. The use of reduced-order approximation facilitates numerical computations by reducing the number of multiplier initial values that must be determined simultaneously and by improving the conditioning of the differential equations.

Kelley, H. J.↗

Analytic approximations in the study of the solar modulation of electrons

Numerical solutions to the transport equation of galactic cosmic rays in the interplanetary medium have been used to investigate the applicability of commonly used approximate analytic solutions for electrons (10 MeV to 10 GeV). We find that for a given cosmic-ray diffusion coefficient the force-field approximation is in reasonable agreement with the numerical solution at energies above 200 MeV, but deviates significantly at lower energies, depending on the shape of the interstellar electron spectrum. The diffusion-convection approximation agrees generally with the numerical solution within a factor of 2 over the entire energy range.

Cummings, A. C.↗

Digital approximation of continuous-data control systems by point-by-point state comparison

This paper presents a point-by-point state comparison method of approximating a continuous-data system by a sampled-data system. The problem is to attempt the matching of the states of the two systems at the sampling instants. A partial matching has to be conducted if the systems have more states than controls. A weighting matrix is used to regulate the partial matching and weights placed on each state. The digital approximation is affected by use of forward gain E(T) and feedback gain G(T) in the sampled-data system. It is shown that, in general, these gains can be approximated by truncated Taylor series expansions. An illustrative example is given using the one-axis dynamics of the Skylab satellite.

Kuo, B. C.↗

Approximate techniques of structural reanalysis

A study is made of two approximate techniques for structural reanalysis. These include Taylor series expansions for response variables in terms of design variables and the reduced-basis method. In addition, modifications to these techniques are proposed to overcome some of their major drawbacks. The modifications include a rational approach to the selection of the reduced-basis vectors and the use of Taylor series approximation in an iterative process. For the reduced basis a normalized set of vectors is chosen which consists of the original analyzed design and the first-order sensitivity analysis vectors. The use of the Taylor series approximation as a first (initial) estimate in an iterative process, can lead to significant improvements in accuracy, even with one iteration cycle. Therefore, the range of applicability of the reanalysis technique can be extended. Numerical examples are presented which demonstrate the gain in accuracy obtained by using the proposed modification techniques, for a wide range of variations in the design variables.

Noor, A. K.↗