Density functional theory calculations of small ZnmSn clusters

2001-07-16
Katırcıoğlu, Şenay
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We have investigated the structural and electronic properties of isolated neutral ZnmSn clusters for m + n less than or equal to 4 by performing density functional theory calculations at B3LYP level. We have obtained the optimum geometries, the electronic structures, and the possible dissociation channels of the clusters considered.
ZnmSn clusters, Density functional theory, B3LYP
https://hdl.handle.net/11511/49110
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Department of Physics, Article

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Citation Formats
Ş. Katırcıoğlu, “Density functional theory calculations of small ZnmSn clusters,” JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, pp. 99–106, 2001, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/49110.
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