Molecular dynamics calculations of CO2/N2 mixture through the NaY type zeolite membrane

Koichi Mizukami, Hiromitsu Takaba, Yasunori Kobayashi, Yasunori Oumi, Rodion Vladimirovich Belosludov, Seiichi Takami, Momoji Kubo, Akira Miyamoto

Research output: Contribution to journalArticlepeer-review

25 Citations (Scopus)


The separation of carbon dioxide from the carbon dioxide and nitrogen mixture, using NaY inorganic separation membrane, was calculated by molecular dynamics (MD) method. Computer graphic images reveal that carbon dioxide molecules are adsorbed on the sodium cation, located at site II. This site plays an important role in the separation of carbon dioxide.

Original languageEnglish
Pages (from-to)21-28
Number of pages8
JournalJournal of Membrane Science
Issue number1
Publication statusPublished - 2001 Jun 30


  • Carbon dioxide
  • Membrane
  • Molecular dynamics
  • Separation
  • Zeolite

ASJC Scopus subject areas

  • Biochemistry
  • Materials Science(all)
  • Physical and Theoretical Chemistry
  • Filtration and Separation

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