| ID | 34139 |
| フルテキストURL | |
| 著者 |
Hamada, Yoshinobu
Department of Chemistry, Faculty of Science, Okayama University
Koga, Kenichiro
Department of Chemistry, Faculty of Science, Okayama University
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Tanaka, Hideki
Department of Chemistry, Faculty of Science, Okayama University
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| 抄録 | Correlation between phase behaviors of a Lennard-Jones fluid in and outside a pore is examined over wide thermodynamic conditions by grand canonical Monte Carlo simulations. A pressure tensor component of the confined fluid, a variable controllable in simulation but usually uncontrollable in experiment, is related with the pressure of a bulk homogeneous system in equilibrium with the confined system. Effects of the pore dimensionality, size, and attractive potential on the correlations between thermodynamic properties of the confined and bulk systems are clarified. A fluid-wall interfacial tension defined as an excess grand potential is evaluated as a function of the pore size. It is found that the tension decreases linearly with the inverse of the pore diameter or width.
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| キーワード | MONTE-CARLO-SIMULATION
CARBON NANOTUBES
WATER
TRANSITION
NANOSPACES
ADSORPTION
NANOPORES
SURFACE
LIQUID
WALLS
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| 備考 | Digital Object Identifer:10.1063/1.2759926
Published with permission from the copyright holder. This is the institute's copy, as published in Journal of Chemical Physics, AUG 2007, Volume 127, Issue 8. Publisher URL:http://dx.doi.org/10.1063/1.2759926 Direct access to Thomson Web of Science record Copyright © 2007 American Institute of Physics |
| 発行日 | 2007-08-28
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| 出版物タイトル |
Journal of Chemical Physics
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| 巻 | 127巻
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| 号 | 8号
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| 出版者 | American Institute of Physics
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| ISSN | 0021-9606
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| NCID | AA00694991
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| 資料タイプ |
学術雑誌論文
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| 言語 |
英語
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| 著作権者 | American Institute of Physics
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| 論文のバージョン | publisher
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| 査読 |
有り
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| DOI | |
| PubMed ID | |
| Web of Science KeyUT | |
| Submission Path | physics_general/30
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