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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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A direct ab initio molecular dynamics (MD) study on the benzophenone-water 1 : 1 complex

Hiroto Tachikawa1, Tetsuji Iyama, Kohichi Kato

  • 1Division of Materials Chemistry, Graduate School of Engineering, Hokkaido University, Sapporo 060-8628, Japan. hiroto@eng.hokudai.ac.jp

Physical Chemistry Chemical Physics : PCCP
|July 10, 2009
PubMed

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