Molecular modeling of the green leaf volatile methyl salicylate on atmospheric air/water interfaces.

@article{LiyanaArachchi2013MolecularMO,
  title={Molecular modeling of the green leaf volatile methyl salicylate on atmospheric air/water interfaces.},
  author={Thilanga P. Liyana-Arachchi and Amie Kathryn Hansel and Christopher Stevens and Franz S. Ehrenhauser and Kalliat T. Valsaraj and Francisco R Hung},
  journal={The journal of physical chemistry. A},
  year={2013},
  volume={117 21},
  pages={
          4436-43
        }
}
Methyl salicylate (MeSA) is a green leaf volatile (GLV) compound that is emitted in significant amounts by plants, especially when they are under stress conditions. GLVs can then undergo chemical reactions with atmospheric oxidants, yielding compounds that contribute to the formation of secondary organic aerosols (SOAs). We investigated the adsorption of MeSA on atmospheric air/water interfaces at 298 K using thermodynamic integration (TI), potential of mean force (PMF) calculations, and… CONTINUE READING
BETA

References

Publications referenced by this paper.
SHOWING 1-10 OF 65 REFERENCES

Similar Papers

Loading similar papers…