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DFT tests for group 8 transition metal carbonyl complexes

Pipsa Hirva1, Matti Haukka, Minna Jakonen

  • 1Department of Chemistry, University of Joensuu, P.O. Box 111, FI-80101, Joensuu, Finland. pipsa.hirva@joensuu.fi

Journal of Molecular Modeling
|January 8, 2008
PubMed

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Transition metals are defined as those elements that have partially filled d orbitals. As shown in Figure 1, the d-block elements in groups 3–12 are transition elements. The f-block elements, also called inner transition metals (the lanthanides and actinides), also meet this criterion because the d orbital is partially occupied before the f orbitals.
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