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Providing specialist reviews and analyses of contemporary theories, algorithms, and techniques, this series aims to facilitate the effective exploitation of available computing power. The current volume focuses on the theoretical determination of atomic and molecular properties as related to wave functions, electron densities, and total energies.
Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field one that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. In this volume the readers are presented with an exciting combination of themes. Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology Features detailed reviews written by leading international researchers
Diatomic Interaction Potential Theory, Volume 2: Applications discusses the variety of applicable theoretical material and approaches in the calculations for diatomic systems in their ground states. The volume covers the descriptions and illustrations of modern calculations. Chapter I discusses the calculation of the interaction potential for large and small values of the internuclear distance R (separated and united atom limits). Chapter II covers the methods used for intermediate values of R, which in principle means any values of R. The Hartree-Fock and configuration interaction schemes described here have been the most used of all the methods. Semiempirical theories and methods constitute the subject of the last chapter. The book will be of value to physicists and students of physics.
Atomic Processes and Applications is a collection of review articles that discusses major atomic and molecular processes and their applications to upper atmospheric physics and to astrophysics. The book also serves as a 60th birthday tribute to Dr. David R. Bates. The coverage of the text includes the overview of stratospheric aeronomy; upper atmosphere of the earth; and problems in atmospheric pollution. The book also deals with technical and highly specialized issues including photoionization of atomic systems; atomic structure and oscillator strengths; and atomic scattering computations. The text will be of great use to undergraduate students and researchers of nuclear, theoretical, and quantum physics.