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Investigation of Phase Behaviors for Associating Lennard-Jones Fluids Confined in Slit Pores
Wu Huijie; Li Xiaosen
2010-09-14
发表期刊ACTA CHIMICA SINICA
卷号68期号:17页码:1681-1686
摘要The phase behaviors of two-site associating Lennard-Jones(LJ) fluid confined in slit pores were investigated by using the modified fundamental measure theory (MFMT) and density functional theory (DFT). The phase equilibria were determined according to the requirement that temperature, chemical potential and grand potential in both phases should be equal. The influences of association energy and pore width on the thermodynamic properties including equilibrium density distributions of molecules and monomers, adsorption and desorption isotherms, and vapor-liquid coexistence were demonstrated.
文章类型Article
关键词Two-site Associating Lennard-jones Fluid Slit Pore Phase Behavior Density Functional Theory
WOS标题词Science & Technology ; Physical Sciences
研究领域[WOS]Chemistry
关键词[WOS]DENSITY-FUNCTIONAL THEORY ; FUNDAMENTAL-MEASURE-THEORY ; INTERFACIAL PROPERTIES ; ADSORPTION PREDICTION ; SURFACE-TENSION ; GAS-ADSORPTION ; ACTIVE CARBONS ; SOLID-SURFACES ; EQUILIBRIA ; TRANSITIONS
收录类别SCI
语种英语
WOS类目Chemistry, Multidisciplinary
WOS记录号WOS:000284511400003
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被引频次:1[WOS]   [WOS记录]     [WOS相关记录]
文献类型期刊论文
条目标识符http://ir.giec.ac.cn/handle/344007/10314
专题中国科学院广州能源研究所
作者单位Chinese Acad Sci, Guangzhou Inst Energy Convers, CAS, Key Lab Renewable Energy & Gas Hydrate, Guangzhou 510640, Guangdong, Peoples R China
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Wu Huijie,Li Xiaosen. Investigation of Phase Behaviors for Associating Lennard-Jones Fluids Confined in Slit Pores[J]. ACTA CHIMICA SINICA,2010,68(17):1681-1686.
APA Wu Huijie,&Li Xiaosen.(2010).Investigation of Phase Behaviors for Associating Lennard-Jones Fluids Confined in Slit Pores.ACTA CHIMICA SINICA,68(17),1681-1686.
MLA Wu Huijie,et al."Investigation of Phase Behaviors for Associating Lennard-Jones Fluids Confined in Slit Pores".ACTA CHIMICA SINICA 68.17(2010):1681-1686.
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