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Effects of the inclusion of a set of 6-311++G** floating basis functions (FBFs) corresponding to the H, He, Li, Be, B, and C atoms, located at the center of molecular cage on the structural and bonding characteristics of the Td symmetric adamantane (A), tetrafluoroadamantane (TFA) and tetracyanoadamantane (TCA), and their anions are studied using B3LYP/(6–311++G** + FBF) method. Results show that...
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