Accommodation of ethanol , acetone and benzaldehyde by the liquid – vapor interface of water : A molecular dynamics study

@inproceedings{Canneaux2006AccommodationOE,
  title={Accommodation of ethanol , acetone and benzaldehyde by the liquid – vapor interface of water : A molecular dynamics study},
  author={S{\'e}bastien Canneaux and Soetens and Eric H{\'e}non and Fr{\'e}d{\'e}ric Bohr},
  year={2006}
}
In the atmosphere, the interaction of volatile organic compounds (VOCs) with liquid droplets is still poorly understood, but it must be included in atmospheric models for a better description of the atmospheric (tropospheric and stratospheric) chemistry. In this study, we have used molecular dynamics simulations to examine the insertion of three VOCs (ethanol, acetone and benzaldehyde) into the liquid– vapor interface of water (using the SPC/E water model). Our results are in agreement with the… CONTINUE READING

References

Publications referenced by this paper.
Showing 1-10 of 40 references

Chem

  • J.-C. Soetens, C. Millot, +4 authors J. Phys
  • B 101
  • 1997
Highly Influential
35 Excerpts

Phys

  • D. E. Smith, L. X. Dang, J. Chem
  • 100
  • 1994
Highly Influential
5 Excerpts

Atmos

  • A. H. Goldstein, G. W. Schade
  • Environ. 34
  • 2000
Highly Influential
3 Excerpts

Chem

  • B. C. Garrett, G. K. Schenter, A. Morita
  • Rev. 106
  • 2006

Chem

  • G. Leyssens, F. Louis, J.-P. Sawerysyn, J. Phys
  • A 109
  • 2005

Phys

  • M. Schütze, H. Herrmann
  • Chem. Chem. Phys. 6
  • 2004

Phys

  • S. Canneaux, N. Sokolowski-Gomez, E. Henon, F. Bohr, S. Dobé
  • Chem. Chem. Phys. 6
  • 2004

React

  • S. Canneaux, E. Henon, F. Bohr
  • Kinet. Catal. Lett. 82 (1)
  • 2004

Chem

  • R. K. Talukdar, T. Gierczak, D. C. McCabe, A. R. Ravishankara, J. Phys
  • A 107
  • 2003

Chem

  • J. P. Reid, R. M. Sayer
  • Soc. Rev. 32
  • 2003