Capillary phenomena in the framework of the two-dimensional density functional theory
被引:6
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作者:
Ustinov, EA
论文数: 0引用数: 0
h-index: 0
机构:Univ Queensland, Dept Chem Engn, St Lucia, Qld 4072, Australia
Ustinov, EA
Do, DD
论文数: 0引用数: 0
h-index: 0
机构:
Univ Queensland, Dept Chem Engn, St Lucia, Qld 4072, AustraliaUniv Queensland, Dept Chem Engn, St Lucia, Qld 4072, Australia
Do, DD
[1
]
机构:
[1] Univ Queensland, Dept Chem Engn, St Lucia, Qld 4072, Australia
[2] St Petersburg State Technol Inst, St Petersburg 190013, Russia
来源:
ADSORPTION-JOURNAL OF THE INTERNATIONAL ADSORPTION SOCIETY
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2005年
/
11卷
/
Suppl 1期
关键词:
adsorption;
cylindrical pore;
density functional theory;
capillary condensation;
nucleation;
D O I:
10.1007/s10450-005-5911-x
中图分类号:
O64 [物理化学(理论化学)、化学物理学];
学科分类号:
070304 ;
081704 ;
摘要:
We present results of application of the density functional theory (DFT) to adsorption and desorption in finite and infinite cylindrical pores accounting for the density distribution in radial and axial directions. Capillary condensation via formation of bridges is considered using canonical and grand canonical versions of the 2D DFT. The potential barrier of nucleation is determined as a function of the bulk pressure and the pore diameter. In the framework of the conventional assumptions on intermolecular interactions both 1D and 2D DFT versions lead to the same results and confirm the classical scenario of condensation and evaporation: the condensation occurs at the vapor-like spinodal point, and the evaporation corresponds to the equilibrium transition pressure. The analysis of experimental data on argon and nitrogen adsorption on MCM-41 samples seems to not completely corroborate this scenario, with adsorption branch being better described by the equilibrium pressure - diameter dependence. This points to the necessity of the further development of basic representations on the hysteresis phenomena.
机构:
Univ Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Zulkifli, N. A. A.
Said, S. M.
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机构:
Univ Malaya, Dept Elect Engn, Kuala Lumpur 50603, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Said, S. M.
Taib, M. F. M.
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h-index: 0
机构:
Univ Teknol MARA, Fac Appl Sci, Shah Alam 40450, Selangor, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Taib, M. F. M.
Arifin, K.
论文数: 0引用数: 0
h-index: 0
机构:
Univ Kebangsaan Malaysia, Fuel Cell Ctr, Bangi 43600, Selangor, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Arifin, K.
Mahmood, S. M.
论文数: 0引用数: 0
h-index: 0
机构:
Univ Teknol MARA, Fac Appl Sci, Jengka Campus, Bandar Tun Razak 26400, Pahang, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Mahmood, S. M.
Woon, K. L.
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h-index: 0
机构:
Univ Malaya, Dept Phys, Low Dimens Mat Res Ctr, Kuala Lumpur 50603, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Woon, K. L.
Patel, Shobhit K.
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h-index: 0
机构:
Marwadi Univ, Dept Elect & Commun, Rajkot 360003, Gujarat, IndiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Patel, Shobhit K.
Tan, C. L.
论文数: 0引用数: 0
h-index: 0
机构:
Nanjing Univ Posts & Telecommun, Sch Elect & Opt Engn, Xianlin Campus, Nanjing 210023, Jiangsu, Peoples R China
Nanjing Univ Posts & Telecommun, Coll Microelect, Xianlin Campus, Nanjing 210023, Jiangsu, Peoples R ChinaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
Tan, C. L.
Zakaria, R.
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机构:
Univ Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, MalaysiaUniv Malaya, Photon Res Ctr, Fac Sci, Kuala Lumpur 50603, Malaysia
机构:
Wuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R ChinaWuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R China
He, Qiu
Yu, Bin
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h-index: 0
机构:
Wuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R ChinaWuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R China
Yu, Bin
Li, Zhaohuai
论文数: 0引用数: 0
h-index: 0
机构:
Wuhan Univ Technol, State Key Lab Adv Technol Mat Synth & Proc, Wuhan 430070, Hubei, Peoples R ChinaWuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R China
Li, Zhaohuai
Zhao, Yan
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机构:
Wuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R China
Wuhan Univ, Inst Technol Sci, Wuhan 430072, Hubei, Peoples R ChinaWuhan Univ Technol, Int Sch Mat Sci & Engn, State Key Lab Silicate Mat Architectures, Wuhan 430070, Hubei, Peoples R China
机构:
Islamic Azad Univ, Fac Sci, Dept Appl Chem, South Tehran Branch, Tehran, IranIslamic Azad Univ, Fac Sci, Dept Appl Chem, South Tehran Branch, Tehran, Iran
Sourani, Maryam
Khodadadi, Zahra
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机构:
Islamic Azad Univ, Fac Sci, Dept Appl Chem, South Tehran Branch, Tehran, IranIslamic Azad Univ, Fac Sci, Dept Appl Chem, South Tehran Branch, Tehran, Iran
Khodadadi, Zahra
Zeeb, Mohsen
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机构:
Islamic Azad Univ, Fac Sci, Dept Appl Chem, South Tehran Branch, Tehran, IranIslamic Azad Univ, Fac Sci, Dept Appl Chem, South Tehran Branch, Tehran, Iran