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NASA NTRS1988

Three-dimensional self-adaptive grid method for complex flows

A self-adaptive grid procedure for efficient computation of three-dimensional complex flow fields is described. The method is based on variational principles to minimize the energy of a spring system analogy which redistributes the grid points. Grid control parameters are determined by specifying maximum and minimum grid spacing. Multidirectional adaptation is achieved by splitting the procedure into a sequence of successive applications of a unidirectional adaptation. One-sided, two-directional constraints for orthogonality and smoothness are used to enhance the efficiency of the method. Feasibility of the scheme is demonstrated by application to a multinozzle, afterbody, plume flow field. Application of the algorithm for initial grid generation is illustrated by constructing a three-dimensional grid about a bump-like geometry.

Djomehri, M. Jahed↗

NASA NTRS1989

Mixed finite element models for free vibrations of thin-walled beams

Simple, mixed finite element models are developed for the free vibration analysis of curved thin-walled beams with arbitrary open cross section. The analytical formulation is based on a Vlasov's type thin-walled beam theory with the effects of flexural-torsional coupling, transverse shear deformation and rotary inertia included. The fundamental unknowns consist of seven internal forces and seven generalized displacements of the beam. The element characteristic arrays are obtained by using a perturbed Lagrangian-mixed variational principle. Only C(sup o) continuity is required for the generalized displacements. The internal forces and the Lagrange multiplier are allowed to be discontinuous at interelement boundaries. Numerical results are presented to demonstrate the high accuracy and effectiveness of the elements developed. The standard of comparison is taken to be the solutions obtained by using 2-D plate/shell models for the beams.

Noor, Ahmed K.↗

NASA NTRS1989

Mixed formulation for frictionless contact problems

Simple mixed finite element models and a computational precedure are presented for the solution of frictionless contact problems. The analytical formulation is based on a form of Reissner's large rotation theory of the structure with the effects of transverse shear deformation included. The contact conditions are incorporated into the formulation by using a perturbed Lagrangian approach with the fundamental unknowns consisting of the internal forces (stress resultants), the generalized displacements, and the Lagrange multipliers associated with the contact conditions. The element characteristic array are obtained by using a modified form of the two-field Hellinger-Reissner mixed variational principle. The internal forces and the Lagrange multipliers are allowed to be discontinuous at interelement boundaries. The Newton-Raphson iterative scheme is used for the solution of the nonlinear algebraic equations, and the determination of the contact area and the contact pressures.

Noor, Ahmed K.↗

NASA NTRS1989

Vector potential methods

Vector potential and related methods, for the simulation of both inviscid and viscous flows over aerodynamic configurations, are briefly reviewed. The advantages and disadvantages of several formulations are discussed and alternate strategies are recommended. Scalar potential, modified potential, alternate formulations of Euler equations, least-squares formulation, variational principles, iterative techniques and related methods, and viscous flow simulation are discussed.

Hafez, M.↗

NASA NTRS1989

Application of the p-version of the finite-element method to global-local problems

A brief survey is given of some recent developments in finite-element analysis technology which bear upon the three main research areas under consideration in this workshop: (1) analysis methods; (2) software testing and quality assurance; and (3) parallel processing. The variational principle incorporated in a finite-element computer program, together with a particular set of input data, determines the exact solution corresponding to that input data. Most finite-element analysis computer programs are based on the principle of virtual work. In the following, researchers consider only programs based on the principle of virtual work and denote the exact displacement vector field corresponding to some specific set of input data by vector u(EX). The exact solution vector u(EX) is independent of the design of the mesh or the choice of elements. Except for very simple problems, or specially constructed test problems, vector u(EX) is not known. Researchers perform a finite-element analysis (or any other numerical analysis) because they wish to make conclusions concerning the response of a physical system to certain imposed conditions, as if vector u(EX) were known.

Szabo, Barna A.↗

NASA NTRS1988

Electron-CF4 elastic scattering in the static-exchange approximation

Differential, integral, and momentum-transfer cross sections for the elastic scattering of electrons by CF4 from 5 to 35 eV are reported. The calculations were carried out at the fixed-nuclei, static-exchange level usign the Schwinger variational principle. Analyses of the partial channel amplitudes show four broad shape resonances; two in T2, one in A1, and one in E symmetries. The positions of these resonances agree with experimental data from total-cross-section measurements, dissociative attachment studies, and low-energy electron excitation spectra, the only exception being the 8.9-eV structure in the total-cross-section data. No experimental measurements on differential cross sections are available, but comparing with the corresponding static-exchange calculations for the e-CH4 system, the e-CF4 cross sections generally are less backward peaked.

Huo, Winifred M.↗

NASA NTRS1988

Cross sections for excitation of the b 3Sigma(+)u, a 3Sigma(+)g, and c 3Pi(u) states of H2 by low-energy electrons

An extension of the Schwinger variational principle is used to study the cross sections for the excitation of certain transitions in H2 by low-energy electrons. The results are compared with available experimental data.

Lima, M. A. P.↗

NASA NTRS1989

Studies of elastic e-NH3 collisions

Differential and momentum-transfer cross sections for the elastic scattering of electrons by NH3 have been obtained for collision energies of between 2.5 and 20 eV using the fixed-nuclei static-exchange approximation of the Schwinger variational principle. At intermediate and large scattering angles, good agreement is found between calculated and relative experimental cross sections. The differential cross sections reveal evidence of a weak d-wave enhancement around 8 eV.

Pritchard, H. P.↗

NASA NTRS1989

Direct calculation of the reactive transition matrix by L-squared quantum mechanical variational methods with complex boundary conditions

A new formalism of the generalized Newton variational principle for the calculation of quantum mechanical state-to-state reaction probabilities is presented. The reformulation involves solving directly for the transition matrix rather than the reactance mtrix so that calculations may be carried out for individual columns of the transition matrix without obtaining solutions for all possible initial channels. The convergence of calculations with real and complex boundary conditions are compared for H + H2 - H2 + H, O + H2 - OH + H, and O + HD - OH + D and OD + H.

Sun, Yan↗

NASA NTRS1988

Computational strategies and improvements in the linear algebraic variational approach to rearrangement scattering

The computational steps in calculating quantum mechanical reactive scattering amplitudes by the L2 generalized Newton variational principle are discussed with emphasis on computational strategies and recent improvements that make the calculations more efficient. Special emphasis is placed on quadrature techniques, storage management strategies, use of symmetry, and boundary conditions. It is concluded that an efficient implementation of these procedures provides a powerful algorithm for the accurate solution of the Schroedinger equation for rearrangements.

Schwenke, David W.↗

NASA NTRS1989

Nonaxisymmetric instabilities in thin self-gravitating rings and disks

The stability of geometrically thin self-gravitating rings and disks is studied by computing the eigenvalues and eigenfunctions of linearized normal mode oscillations in these systems. For the vertically averaged incompressible models and models of gaseous and stellar disks with softened gravity, analytic treatment is possible. The existence of oscillatory normal modes is established using a variational principle and infer instability using perturbation theory. Effects due to the Lindblad and corotation resonances are analyzed in detail. The distribution of the ratio of vorticity to surface density is important for determining the stability of the systems.

Papaloizou, John C. B.↗

NASA NTRS1990

Spin bipolaron in the framework of emery model for high-T(sub c) copper oxide superconductors

The high-T(sub c) oxide compounds discovered recently exhibit a number of interesting physical properties. Two-dimensional antiferromagnetic spin order has been observed in these materials at the oxygen deficiency. This fact can be explained by strong correlation of the spins, situated on Cu sites in the conducting planes of the oxide superconductors. The doping or the oxygen deficiency lead to the occurrence of holes, occupying the oxygen p-orbitals according to the Emery model. At the small hole concentration they can move along the antiferromagnetic lattice of spins, localized on Cu sites. Researchers consider the two holes situation and describe in what way their behavior depends on the antiferromagnetic exchange interation J. It is known that in the framework of Hubbard model with strong on-site Coulomb repulsion, a single hole can form a spin polaron of the large radius. It is reasonable to admit that two holes with parallel spins (triplet) form the spin bipolaron complex owing to the hole excitations' capability to polarize Cu spin surroundings. Such an excitation was considered in the phenomenological way. Here the problem is discussed on the basis of the microscopic approach in the framework of the variational principle. A special kind of wave function is used for such a purpose. The wave function is constructed by generalizing the trial functions proposed in over two holes excitation situation (triplet) and then the region of spin bipolaron existance in the framework of Emery model is studied. In this model the Hamiltonian can be easily rewritten by forming the oxygen states transforming as the irreducible representations of the group D(sub 4).

Golub, A. A.↗

NASA NTRS1989

Mixed finite element models for free vibrations of thin-walled beams

Noor, Ahmed K.↗

NASA NTRS1988

Three-dimensional self-adaptive grid method for complex flows

Djomehri, M. Jahed↗

NASA NTRS1989

Transition regime droplet growth and evaporation - An integrodifferential variational approach

A variational principle based on the integrodifferential form of the Boltzmann equation, which allows very general forms of the collision integral and of the boundary operator, has been used to compute the mass flux to a spherical particle. For simplicity the problem has been restricted to the one-speed, constant cross-section approximation, the black sphere problem of neutron transport theory. Using the Hilbert expansion of the solution far from the sphere as a trial function leads to a rational expression in the inverse Knudsen number for the extrapolation distance, which is simply related to the number flux to the sphere. A five-term expansion gives results that are no more than 6 percent in error when compared to an accurate numerical solution. The technique can be applied to other forms of the collision model and other boundary conditions.

Cipolla, J. W., Jr.↗

NASA NTRS1989

Developments in variational methods for high performance plate and shell elements

This paper is part of a series on the variational foundations of high-performance elements, with emphasis on plate and shell elements constructed with the free formulation (FF) and assumed natural strain (ANS) methods. Attention is given to parametrized variational principles that provide a common foundation for the FF and ANS methods, as well as a combination of both. From this unified formulation, a variant of the ANS formulation called the 'assumed natural deviatoric strain' (ANDES) formulation, emerges as an important case. The first ANDES element, a high-performance 9-dof triangular Kirchhoff plate bending element, is briefly described to illustrate the use of the new formulation.

Felippa, C. A.↗

NASA NTRS1991

Norms And Completeness In Variational Methods

Paper discusses significance of norms and completeness in analyses based on variational principle of mechanics. Such analyses conducted to determine static deflections and/or vibrations of structures, including complicated ones like spacecraft. Illustrates by example that such casual approaches lead to erroneous results.

Storch, Joel A.↗

NASA NTRS1989

SAGE: A 2-D self-adaptive grid evolution code and its application in computational fluid dynamics

SAGE is a user-friendly, highly efficient, two-dimensional self-adaptive grid code based on Nakahashi and Deiwert's variational principles method. Grid points are redistributed into regions of high flowfield gradients while maintaining smoothness and orthogonality of the grid. Efficiency is obtained by splitting the adaption into 2 directions and applying one-sided torsion control, thus producing a 1-D elliptic system that can be solved as a set of tridiagonal equations.

Davies, Carol B.↗