Croatica Chemica Acta, Vol. 60 No. 2, 1987.
Original scientific paper
Structures and Bonding of Aluminum Dioxygen
S. P. So
; Chemistry Department, The Chinese University of Hong Kong Shatin, N. T., Hong Kong
Abstract
Ab initio molecular orbital calculations on the structures of aluminum dioxygen have been performed using double-zeta plus polarization basis functions. The asymmetric beni AlOO isomer is found to be more stable than the symmetric bent OAlO isomer. The Al-O bond is predicted to be best described as covalent with a substantial ionic character.
Keywords
Hrčak ID:
176347
URI
Publication date:
25.6.1987.
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