論文

2002年11月

How does water freeze inside carbon nanotubes?

PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS
  • K Koga
  • ,
  • GT Gao
  • ,
  • H Tanaka
  • ,
  • XC Zeng

314
1-4
開始ページ
462
終了ページ
469
記述言語
英語
掲載種別
研究論文(学術雑誌)
DOI
10.1016/S0378-4371(02)01074-9
出版者・発行元
ELSEVIER SCIENCE BV

Phase behavior of quasi-one-dimensional water confined inside a carbon nanotube is studied in the thermodynamic space of temperature, pressure, and diameter of the cylindrical container. Four kinds of solid-like ordered structures-ice nanotubes-form spontaneously from liquid-like disordered phases at low temperatures. In the model system that comprises of TIP4P water molecules interacting with each other via short-range Lennard-Jones and long-range Coulomb site-site potentials under a periodic boundary condition in the axial direction, the phase change occurs either discontinuously or continuously depending on the path in the thermodynamic space. That the isotherms for a given diameter are found to be similar to those around the liquid-gas critical point of fluids suggests existence of a phase boundary terminated by a critical point. The apparently-complex phase behavior is accounted for by noting that the phase boundaries are layered surfaces in the three-dimensional thermodynamic space and some of the surfaces are terminated by critical lines. (C) 2002 Elsevier Science B.V. All rights reserved.

リンク情報
DOI
https://doi.org/10.1016/S0378-4371(02)01074-9
Web of Science
https://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=JSTA_CEL&SrcApp=J_Gate_JST&DestLinkType=FullRecord&KeyUT=WOS:000179502800063&DestApp=WOS_CPL
ID情報
  • DOI : 10.1016/S0378-4371(02)01074-9
  • ISSN : 0378-4371
  • Web of Science ID : WOS:000179502800063

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