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Indirect detection of selective nuclear spin–spin interactions in a hostile environment

✍ Scribed by A. Heidebrecht; J. Mende; M. Mehring


Book ID
108275604
Publisher
Elsevier Science
Year
2006
Tongue
English
Weight
229 KB
Volume
29
Category
Article
ISSN
0926-2040

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The Calculation of Indirect Nuclear Spin
✍ 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