𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Ab initio study of isotropic and anisotropic hyperfine interactions in phosphoranyl and phosphorane anion radicals

✍ Scribed by René A.J. Janssen; Henk M. Buck


Book ID
119116185
Publisher
Elsevier Science
Year
1984
Tongue
English
Weight
894 KB
Volume
110
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Ab initio MO LCAO UHF calculations of ma
✍ Jan Almlöf; Anders Lund; Karl-Åke Thuomas 📂 Article 📅 1974 🏛 Elsevier Science 🌐 English ⚖ 350 KB

The magnetic hype&e coupling constants in NO2 and CO, have been computed by ab initio methods. Spin annihfition is found to be essential in order to obtain useful results for the dipolar couplings, but has much Less influence on the isotropic couplings. The electric quadrupole coupling constants hav

Isotropic and anisotropic hyperfine coup
✍ Kenji Morihashi; Tatsuya Nakano; Osamu Kikuchi 📂 Article 📅 1992 🏛 Elsevier Science 🌐 English ⚖ 380 KB

Ab initio single excited configuration interaction calculations of hyperfine coupling constants with Chipman's basis sets suggest that the oxirane radical cation has the ring-opened oxallyl structure, rather than a ring-closed structure.