Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5416947 | Journal of Molecular Structure: THEOCHEM | 2010 | 4 Pages |
Abstract
The lowest-energy structures and low-lying isomers of Pbn (n = 13-18) clusters are obtained by using MP2 method. In the considered configuration and size range, it is found that the lowest-energy structures of Pbn clusters favor compact structures, which is different from the prolate structures of Snn clusters at the same size range. For the lowest-energy structures, our calculated dipole moments indicate that the Pb14 and Pb18 clusters possess large dipole moments, which are in good agreement with available experiment.
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Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Yong-Min Lei, Li-Xia Zhao, Xiao-Juan Feng, Meng Zhang, You-Hua Luo,