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- W2353118144 abstract "Topological properties of charge distribution for the title complexes and their constituent are analyzed by using ab initio calculations at 3-21G basis set. The results obtained are compared with those originated from ab initio and energy decomposition method. It has been determined that the title molecular complexes are T-shaped. The characteristics of the bonds and the changes originated from the formation of the complexes are discussed." @default.
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- W2353118144 date "1993-01-01" @default.
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- W2353118144 title "Quantum Topological Studies on the Molecular Complexes-CO_2-NCH and CO_2-OH_2" @default.
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