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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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A topological method for global optimization of clusters: application to (TiO2)n (n = 1-6)

Lingli Tang1, Linwei Sai, Jijun Zhao

  • 1School of Mathematical Sciences, Dalian University of Technology, Dalian 116024, China.

Journal of Computational Chemistry
|November 1, 2011
PubMed

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