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Laplacian of charge density for binuclear complexes: The metal-metal bond in the Rh24+ unit

✍ Scribed by Carles Bo; Josep M. Poblet; Marc Bénard

Book ID
107734729
Publisher
Elsevier Science
Year
1990
Tongue
English
Weight
789 KB
Volume
169
Category
Article
ISSN
0009-2614

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📜 SIMILAR VOLUMES

The Laplacian of charge density for binu
The Laplacian of charge density for binuclear complexes. A SCF study of V2(μ-η2S2)2(S2CH)4
✍ Miquel Costas; Carles Bo; Josep M. Poblet 📂 Article 📅 1992 🏛 Elsevier Science 🌐 English ⚖ 637 KB

The Laplacian of the charge density has been computed for the binuclear complex V&$S,),(S,CH),. The inner-valence shell charge concentration of the vanadium atom exhibits four maxima. The Fermi hole distributions show the localized nature of the lone pairs of the ligand with a low penetration into