A diagrammatic method for solving angular momentum recoupling problems is presented. It is shown that a few graphical elements with a set of rules for their use lead to the solution of many types of recoupling problems in an intuitive and systematic way. Several examples are given together with exercise to develop the reader's facility with the method. (Author).
Application of quantum mechanics in physics and chemistry often entails manipulation and evaluation of sums and products of coupling coefficients for the theory of angular momentum. Challenges encountered in such work can be tamed by graphical techniques that provide both the insight and analytical power. The book is the first step-by-step exposition of a graphical method grounded in established work. Copious exercises recover standard results but demonstrate the power to go beyond.
Advances in Quantum Chemistry presents surveys of current developments in this rapidly developing field that falls between the historically established areas of mathematics, physics, chemistry, and biology. With invited reviews written by leading international researchers, each presenting new results, it provides a single vehicle for following progress in this interdisciplinary area. Advances in Quantum Chemistry, Volume 51 deals with various aspects of mathematical versus chemical applications. Some parts belong to established scientific domains, where technical progress has been crucial for the development of modern quantum chemistry as well as the quantification problem in spectral resonance analysis. The first chapter in the volume, concerns the calculation of molecular electronic structure to high accuracy, using a variety of one and two-body schemes in the coupled cluster family of methods. Chapter 2 is devoted to Angular Momentum Diagrams. In chapters 3 and 4, the autors portray Chemical Graph Theory (CGT). Advances quantum mechanical signal processing through the fast Padé transform (FPT) are covered in Chapter 5. The concluding chapter gives a mathematical view of molecular equilibria using a Density-Functional Theory (DFT) description. - Publishes articles, invited reviews and proceedings of major international conferences and workshops - Compiled by the leading international researchers in quantum and theoretical chemistry - Highlights the important, interdisciplinary developments
The five-volume set LNCS 9786-9790 constitutes the refereed proceedingsof the 16th International Conference on Computational Science and ItsApplications, ICCSA 2016, held in Beijing, China, in July 2016. The 239 revised full papers and 14 short papers presented at 33 workshops were carefully reviewed and selected from 849 submissions. They are organized in five thematical tracks: computational methods, algorithms and scientific applications; high performance computing and networks; geometric modeling, graphics and visualization; advanced and emerging applications; and information systems and technologies.
This book is concerned with the practical aspects of solving angular momentum problems. The novel but fully tested-out method (the Invariant Graph Method) allows one to write down from a single graph the complete final result of the problem. The drawing of the graph involves very few simple, essentially self-evident rules. Still it is a powerful tool to easily solve the most involved physical problems.The method is introduced step-by-step in a sequence of examples, beginning with the simplest matrix elements, and ending with the most general case of a reaction including angular distributions and correlations. The many-body and particle anti-particle systems are fully developed. All aspects: wave functions, vectors, operators, Fock space state vectors and operators, etc., are treated on the same footing. All concepts of angular momentum theory acquire a transparent meaning. Hence the book is valuable not only as a handbook in problem solving, but extremely so as an adjunct in any course on advanced qunatum physics, atomic, molecular, nuclear and particle physics.
