Computational Atomic Structure: An MCHF Approach deals with the field of computational atomic structure, specifically with the multiconfiguration Hartree-Fock (MCHF) approach and the manner in which this approach is used in modern physics. Beginning with an introduction to computational algorithms and procedures for atomic physics, the book describes the theory underlying nonrelativistic atomic structure calculations (making use of Brett-Pauli corrections for relativistic effects) and details how the MCHF atomic structure software package can be used to this end. The book concludes with a treatment of atomic properties, such as energy levels, electron affinities, transition probabilities, specific mass shift, fine structure, hyperfine-structure, and autoionization. This modern, reliable exposition of atomic structure theory proves invaluable to anyone looking to make use of the authors' MCHF atomic structure software package, which is available publicly via the Internet.
This scientific biography of Douglas R. Hartree not only describes important events in his life but also outlines his contributions to a number of fields. He is best known for his "self-consistent field" theory for atoms, a theory he later used for the much more difficult problem of predicting the behavior of a magnetron. When Fock pre-empted his work on exchange, he began research into radio-wave propagation. Hartree was very interested in the process of computation. When he learned of a differential analyzer for solving differential equations, he first built a model using Meccano, a toy for children. The success of this model spread the notion of using devices to solve scientific problems. Application of the analyzer led Hartree to control theory and fluid dynamics. In both these areas he made significant, original contribution. With his extensive computing background, he was selected as the first civilian to evaluate the possibility of applying the US ENIAC computer to nonmilitary problems. His research touched the lives of many scientists.
Computational Atomic Structure: An MCHF Approach deals with the field of computational atomic structure, specifically with the multiconfiguration Hartree-Fock (MCHF) approach and the manner in which this approach is used in modern physics. Beginning with an introduction to computational algorithms and procedures for atomic physics, the book describes the theory underlying nonrelativistic atomic structure calculations (making use of Brett-Pauli corrections for relativistic effects) and details how the MCHF atomic structure software package can be used to this end. The book concludes with a treatment of atomic properties, such as energy levels, electron affinities, transition probabilities, specific mass shift, fine structure, hyperfine-structure, and autoionization. This modern, reliable exposition of atomic structure theory proves invaluable to anyone looking to make use of the authors' MCHF atomic structure software package, which is available publicly via the Internet.
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