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Interactions in Diatomic Dimers Involving Closed-Shell Metals †

✍ Scribed by Patkowski, Konrad; Podeszwa, Rafał; Szalewicz, Krzysztof

Book ID
121252040
Publisher
American Chemical Society
Year
2007
Tongue
English
Weight
265 KB
Volume
111
Category
Article
ISSN
1089-5639

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✍ Andreas Wolf; Hans-Herbert Schmidtke 📂 Article 📅 1980 🏛 John Wiley and Sons 🌐 English ⚖ 874 KB

## Abstract Potential‐energy curves of the 3__d__ dimer series Sc~2~ through Cu~2~ are calculated for the lowest closed‐shell states within the nonempirical RHF formalism using limited basis sets of minimal to near‐double‐zeta–plus‐polarization size. Calculated spectroscopic constants are compared