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Relational analysis of (co)inductive predicates, (co)algebraic datatypes, and (co)recursive functions

โœ Scribed by Jasmin Christian Blanchette

Book ID
118810649
Publisher
Springer US
Year
2011
Tongue
English
Weight
545 KB
Volume
21
Category
Article
ISSN
0963-9314

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Effects of relativity on the Ni๎—ธCO, Pd๎—ธC
Effects of relativity on the Ni๎—ธCO, Pd๎—ธCO, and Pt๎—ธCO bonding mechanism: a constrained space orbital variation analysis of density functional results
โœ Sai-Cheong Chung; Sven Krรผger; Sergey Ph. Ruzankin; Gianfranco Pacchioni; Notker ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 557 KB

Using a density functional based constrained space orbital variation technique, we have analyzed the importance of relativistic effects on the various mechanisms which affect the metal-CO bond in Ni, Pd, and Pt monocarbonyls. The bonding is dominated by the ~r back-donation mechanism which, for Pd a