Four-body cooperativity in hydrophonic association of methane

Journal of Physical Chemistry Letters

Volumn 1, Issue 10, 2010, Pages 1552-1556

  Matsumoto, Masakazu ^a  

^a NAGOYA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ATTRACTION FORCE; COLLOID PARTICLES; COOPERATIVITY; METHANE HYDRATES; METHANE MOLECULES; RANDOM AGGREGATION; SHORT-RANGE FORCES; SOLIDIFICATION PROCESS; SOLVATION COMPLEX; WATER MOLECULE;

AGGLOMERATION; COMPUTATIONAL METHODS; COMPUTER SIMULATION; COORDINATION REACTIONS; CRYSTALLIZATION; HYDRATION; METAL VAPOR LAMPS; METHANE; MOLECULES; SOLIDIFICATION;

GAS HYDRATES;

EID: 77952736007     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz100340e     Document Type: Article

References (24)

1. Moon, C.; Taylor, P. C.; Rodger, P. M. Molecular Dynamics Study of Gas Hydrate Formation J. Am. Chem. Soc. 2003, 125, 4706-4707
2. Zhang, J.-F.; Hawtin, R. W.; Yang, Y.; Nakagava, E.; Rivero, M.; Choi, S. K.; Rodger, P. M. Molecular Dynamics Study of Methane Hydrate Formation at a Water/Methane Interface J. Phys. Chem. B 2008, 112, 10608-10618
3. Walsh, M. R.; Koh, C. A.; Sloan, E. D.; Sum, A. K.; Wu, D. T. Microsecond Simulations of Spontaneous Methane Hydrate Nucleation and Growth Science 2009, 326, 1095-1098
4. 129Xe NMR Experiments with Hyperpolarized Xenon J. Phys. Chem. B 2001, 105, 12338-12347
5. Linga, P.; Haligva, C.; Nam, S.-C.; Ripmeester, J. A.; Englezos, P. Gas Hydrate Formation in a Variable Volume Bed of Silica Sand Particles Energy Fuels 2009, 23, 5496-5507
6. Moudrakovski, I. L.; McLaurin, G. E.; Ratcliffe, C. I.; Ripmeester, J. A. Methane and Carbon Dioxide Hydrate Formation in Water Droplets: Spatially Resolved Measurements from Magnetic Resonance Microimaging J. Phys. Chem. B 2004, 108, 17591-17595
7. Nada, H. Growth Mechanism of a Gas Clathrate Hydrate from a Dilute Aqueous Gas Solution: A Molecular Dynamics Simulation of a Three-Phase System J. Phys. Chem. B 2006, 110, 16526-16534
8. Chung, S.-Y.; Kim, Y.-M.; Kim, J.-G.; Kim, Y.-J. Multiphase Transformation and Ostwalds Rule of Stages During Crystallization of a Metal Phosphate Nat. Phys. 2009, 5, 68-73
9. Ghosh, T.; García, A. E.; Garde, S. Enthalpy and Entropy Contributions to the Pressure Dependence of Hydrophobic Interactions J. Chem. Phys. 2002, 116, 2480-2486
10. Pair attraction force between hydrated methane with various water models is reviewed in Shinto, H.; Morisada, S.; Miyahara, M.; Higashitani, K. A Reexamination of Mean Force Potentials for the Methane Pair and the Constituent Ion Pairs of NaCl in Water J. Chem. Eng. Jpn. 2003, 36, 57-65
11. Czaplewski, C.; Rodziewicz-Motowidło, S.; Liwo, A.; Ripoll, D. R.; Wawak, R. J.; Scheraga, H. Molecular Simulation Study of Cooperativity in Hydrophobic Association Protein Sci. 2000, 9, 1235-1245
12. Widom, B.; Bhimalapuram, P.; Koga, K. The Hydrophobic Effect Phys. Chem. Chem. Phys. 2003, 5, 3085-3093
13. Moghaddam, M. S.; Shimizu, S.; Chan, H. S. Temperature Dependence of Three-Body Hydrophobic Interactions: Potential of Mean Force, Enthalpy, Entropy, Heat Capacity, and Nonadditivity J. Am. Chem. Soc. 2005, 127, 303-316
14. Lüdemann, S.; Schreiber, H.; Abseher, R.; Steinhauser, O. The Influence of Temperature on Pairwise Hydrophobic Interactions of Methane-like Particles: A Molecular Dynamics Study of Free Energy J. Chem. Phys. 1996, 104, 286-295
15. Frank, F. C.; Kasper, J. S. Complex Alloy Structures Regarded as Sphere Packings. II. Analysis and Classification of Representative Structures Acta Crystallogr. 1959, 12, 483-499
16. Kosyakov, V. I. Gas Hydrate Frameworks of Allens Polyhedra. 3. Chemical and Structural Implications of the Topological Properties of the Frameworks J. Struct. Chem. 2003, 44, 1026-1037
17. Dijkstra, M. Phase Behavior of Hard Spheres with a Short-Range Yukawa Attraction Phys. Rev. E 2002, 66, 021402
18. ten Wolde, P. R.; Frenkel, D. Enhancement of Protein Crystal Nucleation by Critical Density Fluctuations Science 1997, 277, 1975-1978
19. Pagan, D. L.; Gunton, J. D. Phase Behavior of Short-Range Square-Well Model J. Chem. Phys. 2005, 122, 184515
20. Fernández, R. G.; Abascal, J. L. F.; Vega, C. The Melting Point of Ice Ih for Common Water Models Calculated from Direct Coexistence of the Solid-Liquid Interface J. Chem. Phys. 2006, 124, 144506
21. Abascal, J. L. F.; Sanz, E.; García Fernández, R.; Vega, C. A Potential Model for the Study of Ices and Amorphous Water: TIP4P/Ice J. Chem. Phys. 2005, 122, 234511
22. PMF of the TIP4P water model at 298 K was also calculated and compared with ref 11 for verification.
23. Jorgensen, W. L.; Ravimohan, C. Monte Carlo Simulation of Differences in Free Energies of Hydration J. Chem. Phys. 1985, 83, 3050-3054
24. Kumar, S.; Bouzida, D.; Swendsen, R. H.; Kollman, P. A.; Rosenberg, J. M. The Weighted Histogram Analysis Method for Free-Energy Calculations on Biomolecules. I. The Method J. Comput. Chem. 1992, 13, 1011-1021