نتایج جستجو برای: ritz energy method

تعداد نتایج: 2205847  

پایان نامه :وزارت علوم، تحقیقات و فناوری - دانشگاه شیراز - دانشکده علوم 1391

some new water-soluble schiff base complexes of na2[m(5-so3-1,2-salophen)].nh2o; (5-so3-1,2-salophen = n,n’-bis(5-sulphosalicyliden)-1,2-phenylendiamine); na2[m(5-so3-2,3-salpyr)(h2o)n].2h2o; (5-so3-2,3-salpyr = n,n’-bis(5-sulphosalicyliden)-2,3-diaminopyridine); and na2[m(5-so3-3,4-salbenz)(h2o)n].nh2o; (5-so3-3,4-salbenz = n,n’-bis(5-sulphosalicyliden)-3,4-diaminobenzophenon); where m = cu, n...

2004
Junhong Park Daniel L. Palumbo

For application of porous and granular materials to vibro-acoustic controls, a finite dynamic strength of the solid component (frame) is an important design factor. The primary goal of this study was to investigate structural vibration damping through this frame wave propagation for various poroelastic materials. A measurement method to investigate the vibration characteristics of the frame was...

Journal: :The Journal of chemical physics 2015
Simen Kvaal Trygve Helgaker

The relationship between the densities of ground-state wave functions (i.e., the minimizers of the Rayleigh-Ritz variation principle) and the ground-state densities in density-functional theory (i.e., the minimizers of the Hohenberg-Kohn variation principle) is studied within the framework of convex conjugation, in a generic setting covering molecular systems, solid-state systems, and more. Hav...

2014
Jing Meng Peiyong Zhu Houbiao Li

Many problems in science and engineering field require the solution of shifted linear systems with multiple right hand sides and multiple shifts. To solve such systems efficiently, the implicitly restarted global GMRES algorithm is extended in this paper. However, the shift invariant property could no longer hold over the augmented global Krylov subspace due to adding the harmonic Ritz matrices...

2007
Gino Rinaldi Muthukumaran Packirisamy Ion Stiharu

Microfabrication limitations are of concern especially for suspended Micro-Electro-Mechanical-Systems (MEMS) microstructures such as cantilevers. The static anddynamic qualities of such microscale devices are directly related to the invariant and variantproperties of the microsystem. Among the invariant properties, microfabrication limitationscan be quantified only after the fabrication of the ...

Journal: :Computer Physics Communications 2011
Jacques Bloch Simon Heybrock

We present an acceleration of the well-established Krylov-Ritz methods to compute the sign function of large complex matrices, as needed in lattice QCD simulations involving the overlap Dirac operator at both zero and nonzero baryon density. Krylov-Ritz methods approximate the sign function using a projection on a Krylov subspace. To achieve a high accuracy this subspace must be taken quite lar...

2007
HUBERT M. JAMES H. M. JAMES

I have been asked to discuss for you some applications of the Rayleigh-Ritz method in physics. Rather than at tempt to survey the whole of a discouragingly large field I have preferred to restrict my attention to some few topics from the theory of atomic and molecular structure. The application of the Rayleigh-Ritz method in this field has been carried out with some care and persistence, and th...

Journal: :Applied Mathematics and Computation 2003
Ji-Huan He

By the semi-inverse method proposed by He, a Lagrangian is established for the large deflection problem of thin circular plate. Ritz method is used to obtain an approximate analytical solution of the problem. First order approximate solution is obtained, which is similar to those in open literature. By Mathematica a more accurate solution can be deduced. 2002 Elsevier Science Inc. All rights re...

1994
Nahid Emad

We make use of the Pad e approximants and Krylov's sequence x; Ax; ; : : :; A m?1 x in the projection methods to compute a few Ritz values of a hermitian matrix A of order n. This process consists of approaching the poles of R x () = ((I ?A) ?1 x; x), the mean value of the resolvant of A, by those of m ? 1=m] Rx (), where m ? 1=m] Rx () is the Pad e approximant of order m of the function R x ()...

Journal: :Math. Comput. 2003
Gerard L. G. Sleijpen Jasper van den Eshof Paul Smit

We derive error bounds for the Rayleigh-Ritz method for the approximation to extremal eigenpairs of a symmetric matrix. The bounds are expressed in terms of the eigenvalues of the matrix and the angle between the subspace and the eigenvector. We also present a sharp bound.

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