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Computation of atomic and molecular processes [electronic resource] : introducing the ATOM-M software suite / Miron Ya. Amusia, Larissa V. Chernysheva.

Amusʹi͡a, M. I͡A. (Miron I͡Ankelevich), author.; Chernysheva, L. V. (Larisa Vladimirovna), author.
2021
QC173
Available Online
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Title
Computation of atomic and molecular processes [electronic resource] : introducing the ATOM-M software suite / Miron Ya. Amusia, Larissa V. Chernysheva.
Author
Amusʹi͡a, M. I͡A. (Miron I͡Ankelevich), author.
Uniform Title
ATOM-M. English
ISBN
9783030851439 (electronic bk.)
3030851435 (electronic bk.)
3030851427
9783030851422
DOI
https://doi.org/10.1007/978-3-030-85143-9
Published
Cham, Switzerland : Springer, 2021.
Language
English
Description
1 online resource.
Item Number
10.1007/978-3-030-85143-9 doi
Call Number
QC173
Dewey Decimal Classification
539.7
Summary
This book presents numerical methods for solving a wide range of problems associated with the structure of atoms and simplest molecules, and their interaction with electromagnetic radiation, electrons, and other particles. It introduces the ATOM-M software package, presenting a unified software suite, written in Fortran, for carrying out precise atomic and molecular numeric calculations. The book shows how to apply these numerical methods to obtain many different characteristics of atoms, molecules, and the various processes within which they interact. In an entirely self-sufficient approach, it teaches the reader how to use the codes provided to build atomic and molecular systems from the ground up and obtain the resulting one-electron wave functions. The computational programs presented and made available in this book allow calculations in the one-electron Hartree-Fock approximation and take into account many-electron correlations within the framework of the random-phase approximation with exchange or many-body perturbation theory. Ideal for scholars interested in numerical computation of atomic and molecular processes, the material presented in this book is useful to both experts and novices, theorists, and experimentalists.
Bibliography, etc. Note
Includes bibliographical references and index.
Access Note
Access limited to authorized users.
Source of Description
Online resource; title from PDF title page (SpringerLink, viewed December 13, 2021).
Added Author
Chernysheva, L. V. (Larisa Vladimirovna), author.
Series
Springer series on atomic, optical, and plasma physics ; 117.
Available in Other Form
Print version: 9783030851422
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Short Review
Physical Content of Programs of the ATOM-M System
Mathematical Description of the Properties of Atomic and Molecular Structure
Wave Functions of the Ground State of Atoms and Simple Molecules in the Hartree-Fock Approximation
Wave Functions of the Ground State of an Atom in the Hartree-Fock-Dirac Approximation
Wave Functions of Excited States of an Atom and Simple Molecules in the Hartree-Fock Approximation.

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