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• W2023177305 abstract "Non-empirical molecular orbital studies on the relative stabilities of topologically closed ring clusters H8Si4O4, [H8Si3AlO4]− and [H8Si2Al2O4]− modelling building units of zeolite frameworks, have been carried out. According to the calculations, AlOAl type bridges are unstable in doubly negative charged species, but can be stabilized in the presence of cations. This stabilization effect increases with increasing cation charge. Several hypothetical bimolecular cluster equilibria are also discussed." @default.
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• W2023177305 date "1982-05-01" @default.
• W2023177305 modified "2023-10-14" @default.
• W2023177305 title "Non-empirical SCF molecular orbital studies on simple zeolite model systems" @default.
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• W2023177305 doi "https://doi.org/10.1016/0166-1280(82)80006-7" @default.
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