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Evidence of indirect spin–spin coupling in crystalline and glassy As–chalcogen compounds

✍ Scribed by E. Ahn; P. Hari; J. Whitaker; G.A. Williams; P.C. Taylor; J. Facelli

Book ID
117146638
Publisher
Elsevier Science
Year
2003
Tongue
English
Weight
96 KB
Volume
326-327
Category
Article
ISSN
0022-3093

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The Calculation of Indirect Nuclear Spin
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✍ Mark A. Watson; Paweł Sałek; Peter Macak; Michał Jaszuński; Trygve Helgaker 📂 Article 📅 2004 🏛 John Wiley and Sons 🌐 English ⚖ 372 KB 👁 1 views

## Abstract We present calculations of indirect nuclear spin–spin coupling constants in large molecular systems, performed using density functional theory. Such calculations, which have become possible because of the use of linear‐scaling techniques in the evaluation of the Coulomb and exchange‐cor