## Abstract Zero‐point vibrational corrections are computed at the BP86/AE1 level for the set of 50 transition‐metal/ligand bonds that have recently been proposed as testing ground for DFT methods, because of the availability of precise experimental gas‐phase geometries (Bühl and Kabrede, J Chem Th
The Versatility of Pentalene Coordination to Transition Metals: A Density Functional Theory Investigation
✍ Scribed by Saïda Bendjaballah; Samia Kahlal; Karine Costuas; Emile Bévillon; Jean-Yves Saillard
- Publisher
- John Wiley and Sons
- Year
- 2006
- Tongue
- English
- Weight
- 916 KB
- Volume
- 12
- Category
- Article
- ISSN
- 0947-6539
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