Phase behavior of clathrate hydrates: a model for single and multiple gas component hydrates

Chemical Engineering Science - Tập 58 - Trang 27-41 - 2003
Jeffery B. Klauda1, Stanley I. Sandler1
1Department of Chemical Engineering, Center for Molecular and Engineering Thermodynamics, University of Delaware, Newark, DE 19719-3119, USA

Tài liệu tham khảo

Ballard, 2000, Optimizing thermodynamic parameters to match methane and ethane structural transition in natural gas hydrate equilibria, Gas Hydrates: Challenges for the Future, 912, 702 Ballard, 2000, Structural transitions in methane plus ethane gas hydrates—Part II, Chemical Engineering Science, 55, 5773, 10.1016/S0009-2509(00)00163-9 Ballard, 2001, Hydrate phase diagrams for methane plus ethane plus propane mixtures, Chemical Engineering Science, 56, 6883, 10.1016/S0009-2509(01)00324-4 Berecz, 1983 Brewer, 1999, Direct experiments on the ocean disposal of fossil fuel CO2, Science, 284, 943, 10.1126/science.284.5416.943 Brewer, 1998, Gas hydrate formation in the deep sea, Energy and Fuels, 12, 183, 10.1021/ef970172q Chase Jr., M. W. (1998). NIST-JANAF thermochemical tables (4th ed.). Washington: American Chemical Soceity. Chou, 2000, Transformations in methane hydrates, Proceedings of the National Academy of Sciences of the United States of America, 97, 13484, 10.1073/pnas.250466497 Dahl, 1991, The Mhv2 Model—a unifac-based equation of state model for prediction of gas solubility and vapor-liquid-equilibria at low and high-pressures, Industrial and Engineering Chemistry Research, 30, 1936, 10.1021/ie00056a041 Davy, 1811, The Bakerian Lecture, Philosophical Transactions of the Royal Society of London, 101, 1 Dyadin, Y. A., Aladko, E. Y., & Larionov, E. G. (1997). Decomposition of methane hydrates up to 15 kbar. Mendeleev Communications (1) 34–35. Dyadin, 2001, Clathrate nitrogen hydrates at pressures of up to 15 kbar, Doklady Physical Chemistry, 378, 159, 10.1023/A:1019274425891 Etters, 1986, High-pressure static and dynamic properties of the R3c phase of solid nitrogen, Physical Review B: Condensed Matter, 33, 8615, 10.1103/PhysRevB.33.8615 Green, 1997 Gutt, 2000, The structure of deuterated methane-hydrate, Journal of Chemical Physics, 113, 4713, 10.1063/1.1288789 Hatzikiriakos, 1993, The relationship between global warming and methane gas hydrates in the earth, Chemical Engineering Science, 48, 3963, 10.1016/0009-2509(93)80375-Z Hatzikiriakos, 1994, Permafrost melting and stability of offshore methane hydrates subject to global warming, International Journal of Offshore and Polar Engineering, 4, 162 Hwang, 1993, Lattice distortion by guest molecules in gas-hydrates, Fluid Phase Equilibria, 83, 437, 10.1016/0378-3812(93)87048-6 Ikeda, 2000, Distortion of host lattice in clathrate hydrate as a function of guest molecule and temperature, Journal of Physical Chemistry A, 104, 10623, 10.1021/jp001313j John, 1982, Contribution of 2nd and subsequent water shells to the potential-energy of guest–host interactions in clathrate hydrates, Journal of Physical Chemistry, 86, 455, 10.1021/j100393a008 John, 1985, Langmuir constants for spherical and linear-molecules in clathrate hydrates—validity of the cell theory, Journal of Physical Chemistry, 89, 3279, 10.1021/j100261a023 Klauda, 2000, A fugacity model for gas hydrate phase equilibria, Industrial and Engineering Chemistry Research, 39, 3377, 10.1021/ie000322b Klauda, 2002, Ab Initio intermolecular potentials for gas hydrates and their predictions, Journal of Physical Chemistry B, 106, 5722, 10.1021/jp0135914 Kuhs, 1997, Cage occupancy and compressibility of deuterated N-2-clathrate hydrate by neutron diffraction, Journal of Inclusion Phenomena and Molecular Recognition in Chemistry, 29, 65, 10.1023/A:1007960217691 Kvenvolden, 1999, Potential effects of gas hydrate on human welfare, Proceedings of the National Academy of Sciences of the United States of America, 96, 3420, 10.1073/pnas.96.7.3420 Larsen, 1987, A modified unifac group-contribution model for prediction of phase-equilibria and heats of mixing, Industrial and Engineering Chemistry Research, 26, 2274, 10.1021/ie00071a018 Lide, 1995 Loveday, 2001, Stable methane hydrate above 2 GPa and the source of Titan's atmospheric methane, Nature, 410, 661, 10.1038/35070513 Mak, 1965, Polyhedral clathrate hydrates. X. structure of the double hydrate of tetrahydrofuran and hydrogen sulfide, Journal of Chemical Physics, 42, 2732, 10.1063/1.1703229 McMullen, 1965, Polyhedral clathrate hydrates. IX. structure of ethylene oxide hydrate, Journal of Chemical Physics, 42, 2725, 10.1063/1.1703228 Morita, 2000, Structure and stability of ethane hydrate crystal, Fluid Phase Equilibria, 169, 167, 10.1016/S0378-3812(00)00320-4 Ng, 1978, Experimental-measurement and prediction of hydrate forming conditions in nitrogen–propane–water system, Fluid Phase Equilibria, 1, 283, 10.1016/0378-3812(77)80011-3 Parrish, 1972, Dissociation pressures of gas hydrates formed by gas mixtures, Industrial Engineering and Chemistry Design and Development, 11, 26, 10.1021/i260041a006 Reed, 1973 Ripmeester, 1987, A new clathrate hydrate structure, Nature, 325, 135, 10.1038/325135a0 Ruzicka, 1996, Simple and controlled extrapolation of vapor pressures toward the triple point, A.I.Ch.E. Journal, 42, 1723, 10.1002/aic.690420624 Sloan, 1998 Sparks, 1999, Configurational properties of water clathrates, Journal of Physical Chemistry B, 103, 6300, 10.1021/jp9903108 Subramanian, 2000, Structural transitions in methane plus ethane gas hydrates—Part I, Chemical Engineering Science, 55, 5763, 10.1016/S0009-2509(00)00162-7 Subramanian, 2000, Evidence of structure II hydrate formation from methane plus ethane mixtures, Chemical Engineering Science, 55, 1981, 10.1016/S0009-2509(99)00389-9 van der Waals, J. H., & Platteeuw, J. C. (1959). Clathrate solutions. Advances in Chemical Physics, 2, 1. van Klaveren, 2001, Molecular dynamics simulation study of the properties of doubly occupied N-2 clathrate hydrates, Journal of Chemical Physics, 115, 10500, 10.1063/1.1415496 van Klaveren, 2001, Stability of doubly occupied N-2 clathrate hydrates investigated by molecular dynamics simulations, Journal of Chemical Physics, 114, 5745, 10.1063/1.1352078 Von Stachelberg, 1954, Zeitschrift fuer Electrochemie, 58, 25 Zele, 1999, A theory of lattice distortion in gas hydrates, Journal of Physical Chemistry B, 103, 10250, 10.1021/jp9917704 Zhang, 2000, Hydrate formation of hydrogen plus hydrocarbon gas mixtures, Journal of Chemical and Engineering Data, 45, 908, 10.1021/je000076a