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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Validation of DFT-based methods for predicting qualitative thermochemistry of large polyaromatics

Karen Hemelsoet1, Freija De Vleeschouwer, Veronique Van Speybroeck

  • 1Center for Molecular Modeling, Ghent University, Technologiepark 903, Zwijnaarde, Belgium. Karen.Hemelsoet@UGent.be

Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|March 26, 2011
PubMed

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