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Autor:
Xian Xing Chi, Xing Zhan Lin
Publikováno v:
Journal of Molecular Modeling. 17:879-888
The stable structures and aromatic characters for three cationic X 3 + (X = Sc, Y, and La) and three relevant neutral X3Cl (X = Sc, Y, La) clusters are investigated at the DFT and post HF level of theory. The calculated results show that the X 3 + ca
Autor:
Xian Xing Chi, Xing Zhan Lin
Publikováno v:
Journal of Molecular Modeling; Apr2011, Vol. 17 Issue 4, p879-888, 10p, 1 Color Photograph, 1 Diagram, 5 Charts