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Large-scale matrix equations of special type

✍ Scribed by Peter Benner

Publisher: John Wiley and Sons
Year: 2008
Tongue: English
Weight: 85 KB
Volume: 15
Category: Article
ISSN: 1070-5325
DOI: 10.1002/nla.621

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## Abstract A linear scaling local correlation approach is proposed for approximately solving the coupled cluster doubles (CCD) equations of large systems in a basis of orthogonal localized molecular orbitals (LMOs). By restricting double excitations from spatially close occupied LMOs into their as