Theoretical and Computational Aspects of Magnetic Organic Molecules

Theoretical and Computational Aspects of Magnetic Organic Molecules
Author: Sambhu N. Datta
Publisher: World Scientific
Total Pages: 346
Release: 2014
Genre: Science
ISBN: 1908977221

Organic materials with extraordinary magnetic properties promise a wide range of light, flexible, and inexpensive alternatives to familiar metal-based magnets. Individual organic molecules with high magnetic moments will be the foundation for design and fabrication of these materials. This book provides a systematic understanding of the structure and properties of organic magnetic molecules. After a summary of the phenomenon of magnetism at the molecular level, it presents a survey of the challenges to theoretical description and evaluation of the magnetic character of open-shell molecules, and an overview of recently developed methods and their successes and shortfalls. Several fields of application, including very strong organic molecular magnets and photo-magnetic switches, are surveyed. Finally, discussions on metal-based materials and simultaneously semiconducting and ferromagnetic extended systems and solids point the way toward future advances. The reader will find a comprehensive discourse on current understanding of magnetic molecules, a thorough survey of computational methods of characterizing known and imagined molecules, simple rules for design of larger magnetic systems, and a guide to opportunities for progress toward organic magnets.

Approximation Theory and Approximation Practice, Extended Edition

Approximation Theory and Approximation Practice, Extended Edition
Author: Lloyd N. Trefethen
Publisher: SIAM
Total Pages: 377
Release: 2019-01-01
Genre: Mathematics
ISBN: 1611975948

This is a textbook on classical polynomial and rational approximation theory for the twenty-first century. Aimed at advanced undergraduates and graduate students across all of applied mathematics, it uses MATLAB to teach the field’s most important ideas and results. Approximation Theory and Approximation Practice, Extended Edition differs fundamentally from other works on approximation theory in a number of ways: its emphasis is on topics close to numerical algorithms; concepts are illustrated with Chebfun; and each chapter is a PUBLISHable MATLAB M-file, available online. The book centers on theorems and methods for analytic functions, which appear so often in applications, rather than on functions at the edge of discontinuity with their seductive theoretical challenges. Original sources are cited rather than textbooks, and each item in the bibliography is accompanied by an editorial comment. In addition, each chapter has a collection of exercises, which span a wide range from mathematical theory to Chebfun-based numerical experimentation. This textbook is appropriate for advanced undergraduate or graduate students who have an understanding of numerical analysis and complex analysis. It is also appropriate for seasoned mathematicians who use MATLAB.

Scientific Computation on Mathematical Problems and Conjectures

Scientific Computation on Mathematical Problems and Conjectures
Author: Richard S. Varga
Publisher: SIAM
Total Pages: 128
Release: 1990-01-01
Genre: Mathematics
ISBN: 9781611970111

Studies the use of scientific computation as a tool in attacking a number of mathematical problems and conjectures. In this case, scientific computation refers primarily to computations that are carried out with a large number of significant digits, for calculations associated with a variety of numerical techniques such as the (second) Remez algorithm in polynomial and rational approximation theory, Richardson extrapolation of sequences of numbers, the accurate finding of zeros of polynomials of large degree, and the numerical approximation of integrals by quadrature techniques. The goal of this book is not to delve into the specialized field dealing with the creation of robust and reliable software needed to implement these high-precision calculations, but rather to emphasize the enormous power that existing software brings to the mathematician's arsenal of weapons for attacking mathematical problems and conjectures. Scientific Computation on Mathematical Problems and Conjectures includes studies of the Bernstein Conjecture of 1913 in polynomial approximation theory, the "1/9" Conjecture of 1977 in rational approximation theory, the famous Riemann Hypothesis of 1859, and the Polya Conjecture of 1927. The emphasis of this monograph rests strongly on the interplay between hard analysis and high-precision calculations.

Approximation Theory, Wavelets and Applications

Approximation Theory, Wavelets and Applications
Author: S.P. Singh
Publisher: Springer Science & Business Media
Total Pages: 580
Release: 2013-03-09
Genre: Mathematics
ISBN: 9401585776

Approximation Theory, Wavelets and Applications draws together the latest developments in the subject, provides directions for future research, and paves the way for collaborative research. The main topics covered include constructive multivariate approximation, theory of splines, spline wavelets, polynomial and trigonometric wavelets, interpolation theory, polynomial and rational approximation. Among the scientific applications were de-noising using wavelets, including the de-noising of speech and images, and signal and digital image processing. In the area of the approximation of functions the main topics include multivariate interpolation, quasi-interpolation, polynomial approximation with weights, knot removal for scattered data, convergence theorems in Padé theory, Lyapunov theory in approximation, Neville elimination as applied to shape preserving presentation of curves, interpolating positive linear operators, interpolation from a convex subset of Hilbert space, and interpolation on the triangle and simplex. Wavelet theory is growing extremely rapidly and has applications which will interest readers in the physical, medical, engineering and social sciences.

African Doctorates in Mathematics

African Doctorates in Mathematics
Author:
Publisher: Lulu.com
Total Pages: 385
Release: 2007
Genre: Reference
ISBN: 1430318678

This volume presents a catalogue of over 2000 doctoral theses by Africans in all fields of mathematics, including applied mathematics, mathematics education and history of mathematics. The introduction contains information about distribution by country, institutions, period, and by gender, about mathematical density, and mobility of mathematicians. Several appendices are included (female doctorate holders, doctorates in mathematics education, doctorates awarded by African universities to non-Africans, doctoral theses by non-Africans about mathematics in Africa, activities of African mathematicians at the service of their communities). Paulus Gerdes compiled the information in his capacity of Chairman of the African Mathematical Union Commission for the History of Mathematics in Africa (AMUCHMA). The book contains a preface by Mohamed Hassan, President of the African Academy of Sciences (AAS) and Executive Director of the Academy of Sciences for the Developing World (TWAS). (383 pp.)

Computational Aspects of General Equilibrium Theory

Computational Aspects of General Equilibrium Theory
Author: Donald Brown
Publisher: Springer Science & Business Media
Total Pages: 204
Release: 2008-01-08
Genre: Business & Economics
ISBN: 3540765913

This monograph presents a general equilibrium methodology for microeconomic policy analysis. It is intended to serve as an alternative to the now classical, axiomatic general equilibrium theory as exposited in Debreu`s Theory of Value (1959) or Arrow and Hahn`s General Competitive Analysis (1971). The monograph consists of several essays written over the last decade. It also contains an appendix by Charles Steinhorn on the elements of O-minimal structures.

Approximation Theory IX: Computational aspects

Approximation Theory IX: Computational aspects
Author: C. K. Chui
Publisher:
Total Pages: 424
Release: 1998
Genre: Mathematics
ISBN:

This meticulously edited selection of papers comes out of the Ninth International Symposium on Approximation Theory held in Nashville, Tennessee, in January, 1998. Each volume contains several invited survey papers written by experts in the field, along with contributed research papers. This book should be of great interest to mathematicians, engineers, and computer scientists working in approximation theory, wavelets, computer-aided geometric design (CAGD), and numerical analysis. Among the topics included in the books are the following: adaptive approximation approximation by harmonic functions approximation by radial basis functions approximation by ridge functions approximation in the complex plane Bernstein polynomials bivariate splines constructions of multiresolution analyses convex approximation frames and frame bases Fourier methods generalized moduli of smoothness interpolation and approximation by splines on triangulations multiwavelet bases neural networks nonlinear approximation quadrature and cubature rational approximation refinable functions subdivision schemes thin plate splines wavelets and wavelet systems

Approximation Theory XIII: San Antonio 2010

Approximation Theory XIII: San Antonio 2010
Author: Marian Neamtu
Publisher: Springer Science & Business Media
Total Pages: 420
Release: 2011-11-19
Genre: Mathematics
ISBN: 1461407729

These proceedings were prepared in connection with the international conference Approximation Theory XIII, which was held March 7–10, 2010 in San Antonio, Texas. The conference was the thirteenth in a series of meetings in Approximation Theory held at various locations in the United States, and was attended by 144 participants. Previous conferences in the series were held in Austin, Texas (1973, 1976, 1980, 1992), College Station, Texas (1983, 1986, 1989, 1995), Nashville, Tennessee (1998), St. Louis, Missouri (2001), Gatlinburg, Tennessee (2004), and San Antonio, Texas (2007). Along with the many plenary speakers, the contributors to this proceedings provided inspiring talks and set a high standard of exposition in their descriptions of new directions for research. Many relevant topics in approximation theory are included in this book, such as abstract approximation, approximation with constraints, interpolation and smoothing, wavelets and frames, shearlets, orthogonal polynomials, univariate and multivariate splines, and complex approximation.

Computational Aspects

Computational Aspects
Author: Carlos A. Brebbia
Publisher: Springer Science & Business Media
Total Pages: 307
Release: 2013-03-12
Genre: Science
ISBN: 3642826636

Past volumes of this series have concentrated on the theoretical and the more formal aspects of the boundary element method. The present book instead stresses the computational aspects of the technique and its applications with the objective of facilitating the implementation of BEM in the engineering industry and its better understanding in the teaching and research environments. The book starts by discussing the topics of convergence of solutions, application to nonlinear problems and numerical integration. This is followed by a long chapter on the computational aspects of the method, discussing the different numerical schemes and the way in which influence functions can be computed. Three separate chapters deal with important techniques which are related to classical boundary elements, namely the edge method, multigrid schemes and the complex variable boundary element approach. The last two chapters are of special interest as they present and explain in detail two FORTRAN codes which have numerous applications in engineering, i.e. a code for the solution of potential problems and another for elastostatics. Each sub routine in the programs is listed and explained. The codes follow the same format as the ones in the classical book "The Boundary Element Method for Engineers" (by C. A. Brebbia, Computational Mechanics Publications, first published in 1978) but are more advanced in terms of elements and capabilities. In particular the new listings deal with symmetry, linear elements for the two dimensional elasticity, some mixed type of boundary conditions and the treatment of infinite regions.