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ChemInform Abstract: Hydride Affinities of Carbonyl Compounds. An ab initio Study.

✍ Scribed by R. E. ROSENBERG


Book ID
112027821
Publisher
John Wiley and Sons
Year
2010
Weight
22 KB
Volume
27
Category
Article
ISSN
0931-7597

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We present results of our ab initio studies of electronic and dynamic properties of ideal palladium hydride PdH and its vacancy ordered defect phase Pd 3 VacH 4 ("Vac" -vacancy on palladium site) with L1 2 crystal structure found experimentally and studied theoretically. Quantum and thermodynamic p