Effect of carrier-gas pressure on barrier to nucleation: Monte Carlo simulation of water/nitrogen system

K. J. Oh, X. C. Zeng

Research output: Contribution to journalArticlepeer-review

19 Scopus citations

Abstract

Monte Carlo simulations were applied to compute the free energy of formation of water clusters in the presence of nitrogen carrier gas. Barrier height of nucleation increased with the carrier gas pressure at low temperature and remained same at high temperatures. These results matched with the binary nucleation theorem and suggested that nucleation pressure will increase with the carrier gas pressure. The density profile showed surface adsorption and results in reduction of surface tension. This causes lower barrier height to nucleation and influences the carrier-gas effect in water/nitrogen system.

Original languageEnglish (US)
Pages (from-to)2681-2686
Number of pages6
JournalJournal of Chemical Physics
Volume114
Issue number6
DOIs
StatePublished - Feb 8 2001

ASJC Scopus subject areas

  • General Physics and Astronomy
  • Physical and Theoretical Chemistry

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