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Separation of the exchange and dipolar contributions to the spin-spin coupling in the donor-acceptor complex TAPD-ZnP-NQ

✍ Scribed by A. van der Est; G. Fuechsle; D. Stehlik; M. R. Wasielewski


Book ID
105719404
Publisher
Springer Vienna
Year
1997
Tongue
English
Weight
952 KB
Volume
13
Category
Article
ISSN
0937-9347

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✍ J. C. Facelli; R. H. Contreras 📂 Article 📅 1981 🏛 John Wiley and Sons 🌐 English ⚖ 497 KB

## Abstract The self‐consistent perturbation theory is used to calculate noncontract contributions to spin–spin coupling constants involving protons. Molecular wave functions were obtained with a modified version of the INDO method which includes hydrogen 2__p__ orbitals in its basis set. It is fou