References
- Sloan , E.D. Jr. 1990 . Clathrate hydrates of natural gases , New York, NY : Marcel Dekker Inc. .
- Hirai , S. , Okazaki , K. , Kuraoka , S. and Kawamura , K. 1996 . Study for the stability of CO2 clathrate-hydrate using molecular dynamics simulation . Energy Convers. Mgmt , 37 : 1087 – 1092 .
- Hirai , S. , Okazaki , K. , Tabe , Y. and Kawamura , K. 1997 . CO2 clathrate-hydrate formation and its mechanism by molecular dynamics simulation . Energy Convers. Mgmt , 38 : S301 – S306 .
- Tse , J.S. and Klug , D.D. 2002 . Formation and decomposition mechanisms for clathrate hydrates . J. Supramol. Chem. , 2 : 467 – 472 .
- Chialvo , A.A. , Houssa , M. and Cummings , P.T. 2002 . Molecular dynamics study of the structure and thermophysical properties of model sI . J. Phys. Chem. B , 106 : 442 – 451 .
- English , N.J. , Johnson , J.K. and Taylor , C.E. 2005 . Molecular-dynamics simulations of methane hydrate dissociation . J. Chem. Phys. , 123 244503
- Ding , L.Y. , Geng , C.Y. , Zhao , Y.H. and Wen , H. 2007 . Molecular dynamics simulation on the dissociation process of methane hydrates . Mol. Sim. , 35 : 1005 – 1016 .
- Myshakin , E.M. , Jiang , H. , Warzinski , R.P. and Jordan , K.D. 2009 . Molecular dynamics simulations of methane hydrate decomposition . J. Phys. Chem. A , 113 : 1913 – 1921 .
- Nose , S. 1984 . A molecular dynamics method for simulations in the canonical ensemble . Mol. Phys. , 52 : 255 – 268 .
- Parrinello , M. and Rahman , A. 1981 . Polymorphic transitions in single crystals: A new molecular dynamics method . J. Appl. Phys. , 52 : 7182 – 7190 .
- McMullan , R.K. and Jeffrey , G.A. 1965 . Polyhedral clathrate hydrates. IX. Structure of ethylene oxide hydrate . J. Chem. Phys. , 42 : 2725 – 2732 .
- Ewald , P. 1921 . The calculation of optical and electrostatic grid potential . Ann. Phys. , 64 : 253 – 287 .
- Martin , M.G. and Siepmann , J.I. 1998 . Transferable potentials for phase equilibria. 1. United-atom description of n-alkanes . J. Phys. Chem. B , 102 : 2569 – 2577 .
- Harris , J.G. and Yung , K.H. 1995 . Carbon dioxide's liquid–vapor coexistence curve and critical properties as predicted by a simple molecular model . J. Phys. Chem. , 99 : 12021 – 12024 .
- Berendsen , H.J.C. , Grigera , J.R. and Straatsma , T.P. 1987 . The missing term in effective pair potentials . J. Phys. Chem. , 91 : 6269 – 6271 .
- Errington , J.R. and Panagiotopoulos , A.Z. 1998 . A fixed point charge model for water optimised to the vapor–liquid coexistence properties . J. Phys. Chem. B , 102 : 7470 – 7475 .
- Errington , J.R. , Boulougouris , G.C. , Economou , I.G. , Panagiotopoulos , A.Z. and Theodorou , D.N. 1998 . Molecular simulation of phase equilibria for water–methane and water–ethane mixtures . J. Phys. Chem. B , 102 : 8865 – 8873 .
- Setzmann , U. and Wagner , W. 1991 . A new equation of state and tables of thermodynamic properties for methane covering the range from the melting line to 625 K at pressures up to 1000 MPa . J. Phys. Chem. Ref. Data , 20 : 1061 – 1155 .