Symmetry-adapted basis sets: automatic generation for problems in chemistry and physics
In theoretical physics, theoretical chemistry and engineering, one often wishes to solve partial differential equations subject to a set of boundary conditions. This gives rise to eigenvalue problems of which some solutions may be very difficult to find. For example, the problem of finding eigenfunc...
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Format: | Elektronisch E-Book |
Sprache: | English |
Veröffentlicht: |
Singapore
World Scientific Pub. Co.
c2012
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Online-Zugang: | FHN01 URL des Erstveroeffentlichers |
Zusammenfassung: | In theoretical physics, theoretical chemistry and engineering, one often wishes to solve partial differential equations subject to a set of boundary conditions. This gives rise to eigenvalue problems of which some solutions may be very difficult to find. For example, the problem of finding eigenfunctions and eigenvalues for the Hamiltonian of a many-particle system is usually so difficult that it requires approximate methods, the most common of which is expansion of the eigenfunctions in terms of basis functions that obey the boundary conditions of the problem. The computational effort needed in such problems can be much reduced by making use of symmetry-adapted basis functions. The conventional method for generating symmetry-adapted basis sets is through the application of group theory, but this can be difficult. This book describes an easier method for generating symmetry-adapted basis sets automatically with computer techniques. The method has a wide range of applicability and can be used to solve difficult eigenvalue problems in a number of fields. The book is of special interest to quantum theorists, computer scientists, computational chemists and applied mathematicians |
Beschreibung: | xi, 227 p. ill. (some col.) |
ISBN: | 9789814350471 |
Internformat
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Datensatz im Suchindex
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any_adam_object | |
author | Avery, John 1933- |
author_facet | Avery, John 1933- |
author_role | aut |
author_sort | Avery, John 1933- |
author_variant | j a ja |
building | Verbundindex |
bvnumber | BV044638471 |
classification_rvk | SK 950 |
collection | ZDB-124-WOP |
ctrlnum | (ZDB-124-WOP)00002572 (OCoLC)1012640248 (DE-599)BVBBV044638471 |
dewey-full | 539.725 |
dewey-hundreds | 500 - Natural sciences and mathematics |
dewey-ones | 539 - Modern physics |
dewey-raw | 539.725 |
dewey-search | 539.725 |
dewey-sort | 3539.725 |
dewey-tens | 530 - Physics |
discipline | Physik Mathematik |
format | Electronic eBook |
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id | DE-604.BV044638471 |
illustrated | Illustrated |
indexdate | 2024-07-10T07:57:53Z |
institution | BVB |
isbn | 9789814350471 |
language | English |
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oclc_num | 1012640248 |
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physical | xi, 227 p. ill. (some col.) |
psigel | ZDB-124-WOP ZDB-124-WOP FHN_PDA_WOP |
publishDate | 2012 |
publishDateSearch | 2012 |
publishDateSort | 2012 |
publisher | World Scientific Pub. Co. |
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spelling | Avery, John 1933- Verfasser aut Symmetry-adapted basis sets automatic generation for problems in chemistry and physics John Scales Avery, Sten Rettrup, James Emil Avery Singapore World Scientific Pub. Co. c2012 xi, 227 p. ill. (some col.) txt rdacontent c rdamedia cr rdacarrier In theoretical physics, theoretical chemistry and engineering, one often wishes to solve partial differential equations subject to a set of boundary conditions. This gives rise to eigenvalue problems of which some solutions may be very difficult to find. For example, the problem of finding eigenfunctions and eigenvalues for the Hamiltonian of a many-particle system is usually so difficult that it requires approximate methods, the most common of which is expansion of the eigenfunctions in terms of basis functions that obey the boundary conditions of the problem. The computational effort needed in such problems can be much reduced by making use of symmetry-adapted basis functions. The conventional method for generating symmetry-adapted basis sets is through the application of group theory, but this can be difficult. This book describes an easier method for generating symmetry-adapted basis sets automatically with computer techniques. The method has a wide range of applicability and can be used to solve difficult eigenvalue problems in a number of fields. The book is of special interest to quantum theorists, computer scientists, computational chemists and applied mathematicians Symmetry (Physics) Rettrup, Sten Sonstige oth Avery, James Emil Sonstige oth Erscheint auch als Druck-Ausgabe 9789814350464 Erscheint auch als Druck-Ausgabe 981435046X http://www.worldscientific.com/worldscibooks/10.1142/8151#t=toc Verlag URL des Erstveroeffentlichers Volltext |
spellingShingle | Avery, John 1933- Symmetry-adapted basis sets automatic generation for problems in chemistry and physics Symmetry (Physics) |
title | Symmetry-adapted basis sets automatic generation for problems in chemistry and physics |
title_auth | Symmetry-adapted basis sets automatic generation for problems in chemistry and physics |
title_exact_search | Symmetry-adapted basis sets automatic generation for problems in chemistry and physics |
title_full | Symmetry-adapted basis sets automatic generation for problems in chemistry and physics John Scales Avery, Sten Rettrup, James Emil Avery |
title_fullStr | Symmetry-adapted basis sets automatic generation for problems in chemistry and physics John Scales Avery, Sten Rettrup, James Emil Avery |
title_full_unstemmed | Symmetry-adapted basis sets automatic generation for problems in chemistry and physics John Scales Avery, Sten Rettrup, James Emil Avery |
title_short | Symmetry-adapted basis sets |
title_sort | symmetry adapted basis sets automatic generation for problems in chemistry and physics |
title_sub | automatic generation for problems in chemistry and physics |
topic | Symmetry (Physics) |
topic_facet | Symmetry (Physics) |
url | http://www.worldscientific.com/worldscibooks/10.1142/8151#t=toc |
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