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Record Details

Record 94 of 1197
Al(+)-ligand binding energies
Author and Affiliation:
Sodupe, M.(NASA Ames Research Center, Moffett Field, CA, United States)
Bauschlicher, Charles W., Jr.(NASA Ames Research Center, Moffett Field, CA, United States)
Abstract: Ab initio calculations are used to optimize the structure and determine the binding energies of Al(+) to a series of ligands. For Al(+)-CN, the bonding was found to have a large covalent component. For the remaining ligands, the bonding is shown to be electrostatic in origin. The results obtained for Al(+) are compared with those previously reported for Mg(+).
Publication Date: Jun 28, 1991
Document ID:
19910069777
(Acquired Nov 28, 1995)
Accession Number: 91A54400
Subject Category: ATOMIC AND MOLECULAR PHYSICS
Document Type: Journal Article
Publication Information: Chemical Physics Letters (ISSN 0009-2614); 181; 321-326
Publisher Information: Netherlands
Financial Sponsor: NASA; United States
Organization Source: NASA Ames Research Center; Moffett Field, CA, United States
Description: 6p; In English
Distribution Limits: Unclassified; Publicly available; Unlimited
Rights: Copyright
NASA Terms: COVALENT BONDS; ELECTROSTATIC BONDING; IONIZATION POTENTIALS; LIGANDS; METAL IONS; NUCLEAR BINDING ENERGY; ALUMINUM; MAGNESIUM
Imprint And Other Notes: Chemical Physics Letters (ISSN 0009-2614), vol. 181, June 28, 1991, p. 321-326.
Availability Source: Other Sources
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