Yin J Z, Ma X R, Zhang X Z, et al. Thermodynamic Properties of Carbon Dioxide Expanded Liquids and Applications in Chemical Reactions [J]. Progress in Chemistry, 2008, 20(9): 1251-1262. (in Chinese)
Houndonougbo Y, Jin H, Rajagopalan B, et al. Phase Equilibria in Carbon Dioxide Expanded Solvents: Experiments and Molecular Simulations [J]. J Phys Chem B, 2006, 110(26): 13195-13202.
[4]
Yin J Z, Tan C S. Solubility of Hydrogen in Toluene for the Ternary System H2+CO2+Toluene from 305 to 343 K and 1. 2 to 10. 5 MPa [J]. Fluid Phase Equilib, 2006, 242(2): 111-117.
[5]
Li H, Maroncelli M. Solvation and Solvatochromism in CO2-Expanded Liquids. 1. Simulations of the Solvent Systems CO2+Cyclohexane, Acetonitrile, and Methanol [J]. J Phys Chem B, 2006, 110(42): 21189-21197.
[6]
Li H, Arzhantsev S, Maroncelli M. Solvation and Solvatochromism in CO2-Expanded Liquids. 2. Experiment-Simulation Comparisons of Preferential Solvation in Three Prototypical Mixtures [J]. J Phys Chem B, 2007, 111(12): 3208-3221.
[7]
Shukla C L, Hallett J P, Popov A V, et al. Molecular Dynamics Simulation of the Cybotactic Region in Gas-Expanded Methanol-Carbon Dioxide and Acetone-Carbon Dioxide Mixtures [J]. J Phys Chem B, 2006, 110(47): 24101-24111.
[8]
Wang W B. A Molecular Simulation Study of Thermodynamics Properties of CO2 Expanded Liquids/Supercritical Fluids [D]. Dalian: Dalian University of Technology, 2008. (in Chinese)
Lin I H, Tan C S. Measurement of Diffusion Coefficients of p-Chloronitrobenzene in CO2-Expanded Methanol [J]. J Supercrit Fluids, 2008, 46(2): 112-117.
[11]
Lin I H, Tan C S. Diffusion of Benzonitrile in CO2-Expanded Ethanol [J]. J Chem Eng Data, 2008, 53(8): 1886-1891.
[12]
Sun H, Rigby D. Polysiloxanes: Ab Initio Force Field and Structural, Conformational and Thermophysical Properties [J]. Spectrochim Acta A, 1997, 53(8): 1301-1323.
[13]
Sun H. COMPASS: An ab Initio Force-Field Optimized for Condensed-Phase Applications Overview with Details on Alkane and Benzene Compounds [J]. J Phys Chem B, 1998, 102(38): 7338-7364.
[14]
Yang J, Ren Y, Tian A M, et al. COMPASS Force Field for 14 Inorganic Molecules, He, Ne, Ar, Kr, Xe, H2, O2, N2, NO, CO, CO2, NO2, CS2, and SO2, in Liquid Phases [J]. J Phys Chem B, 2000, 104(20): 4951-4957.
[15]
Bunte S W, Sun H. Molecular Modeling of Energetic Materials: The Parameterization and Validation of Nitrate Esters in the COMPASS Force Field [J]. J Phys Chem B, 2000, 104(11): 2477-2489.
[16]
Urukova I, Vorholz J, Maurer G. Solubility of Carbon Dioxide in Aqueous Solutions of Methanol. Predictions by Molecular Simulation and Comparison with Experimental Data [J]. J Phys Chem B, 2006, 110(30): 14943-14949.
[17]
Zhu Z Q. Supercritical Fliud Technology-Principle and Application [M]. Beijing: Chemical Industry Press, 2001: 181. (in Chinese)
[18]
朱自强. 超临界流体技术--原理和应用 [M]. 北京: 化学工业出版社, 2001: 181.
[19]
Kordikowski A, Schenk A P, van Nielen R M, et al. Volume Expansions and Vapor-Liquid Equilibria of Binary Mixtures of a Variety of Polar Solvents and Certain Near-Critical Solvents [J]. J Supercrit Fluids, 1995, 8(3): 205-216.
[20]
Morrow T I, Maginn E J. Molecular Dynamics Study of the Ionic Liquid 1-n-Butyl-3-Methylimidazolium Hexafluorophosphate [J]. J Phys Chem B, 2002, 106(49): 12807-12813.
