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Scale-adaptive tensor algebra for local many-body methods of electronic structure theory

✍ Scribed by Lyakh, Dmitry I.


Book ID
125508609
Publisher
John Wiley and Sons
Year
2014
Tongue
English
Weight
502 KB
Volume
114
Category
Article
ISSN
0020-7608

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Group theoretic methods are presented for the transformations of integrals and the evaluation of matrix elements encountered in multiconfigurational self-consistent field (MCSCF) and configuration interaction (CI) calculations. The method has the advantages of needing only to deal with a symmetry un