Grand canonical Monte Carlo investigation of water adsorption in heulandite-type zeolites

Journal of Physical Chemistry B

Volumn 102, Issue 21, 1998, Pages 4045-4048

  Channon, Yvonne M ^a,d   Catlow, C Richard A ^a   Gorman, Alan M ^b   Jackson, Robert A ^c  

^a DAVY FARADAY RESEARCH LABORATORY   (United Kingdom)

^b ACCELRYS INC   (United States)

^c KEELE UNIVERSITY   (United Kingdom)

^d CARDIFF UNIVERSITY   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 11644296647     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp980483h     Document Type: Article

References (20)

1. Ward, R. L.; McKague, H. L. J. Phys. Chem. 1994, 98, 1232.
2. Jentys, A.; Warecka, G.; Derewinski, M.; Lercher, J. A. J. Phys. Chem. 1989, 93, 4837.
3. Callow, C. R. A., Ed. Modelling of Structure and Reactivity in Zeolites; Academic Press: New York, 1992.
4. Shin, J. M.; No, K. T.; Jhon, M. S. J. Phys. Chem. 1988, 92, 4533.
5. Lee, S. H.; Moon, G. K.; Choi, S. G.; Kim, H. S. J. Phys. Chem. 1994, 98, 1561.
6. Richards, A. J.; Watanabe, K.; Austin, N.; Stapleton, M. R. J. Porous Mater. 1995, 2, 43.
7. Wood, G. B.; Rowlinson, J. S. J. Chem. Soc., Faraday Trans. 2 1989, 85, 765.
8. Maddox, M. W.; Rowlinson, J. S. J. Chem. Soc., Faraday Trans. 1993, 89, 3619.
9. Bates, S. P.; Vanwell, W. J. M.; Van Santen, R. A.; Smit, B. J. Phys. Chem. 1996, 100, 17573.
10. Bates, S. P.; Vanwell, W. J. M.; Van Santen, R. A.; Smit, B. J. Am. Chem. Soc. 1996, 118, 6753.
11. Pellenq, R. J.-M.; Tavitian, B.; Espinat, D.; Fuchs, A. H. Langmuir 1996, 12, 4768.
12. Norman, G. E.; Filinov V. S. High Temp. (USSR) 1969, 7, 216.
13. Allen, M. P.; Tildesley D. J. Computer Simulation of Liquids; Clarendon Press: Oxford, 1987.
14. Dauber-Osguthorpe, P.; Roberts, V. A.; Osguthorpe, D. J.; Wolff, J.; Genest, M.; Hagler, A. T. Proteins: Struct. Funct. Genet. 1988, 4, 31.
15. Discover 2.9.8/96.0/4.0.0, User Guide, September 1996, Molecular Simulations, San Diego, CA, 1996.
16. Koyama, K.; Takeuchi, Y. Z. Kristallogr. 1977, 145, 216.
17. Molecular Simulations Inc., 9685 Scranton Road, San Diego, CA 92121.
18. Channon, Y. M.; Catlow, C. R. A.; Jackson, R. A.; Owens, S. Stud. Surf. Sci. Catal. 1995, 97, 117.
19. Heinzinger, K. Computer Modelling of Fluids Polymers and Solids; Catlow, et. al., Eds.; Kluwer Academic Publishers: Dordrecht, 1989; p 357.
20. Mezei, M.; Beveridge, D. L. J. Chem. Phys. 1981, 74, 6902.