Quantitative molecular dynamics simulation of high pressure adsorption isotherms of methane on graphite

Berichte der Bunsengesellschaft/Physical Chemistry Chemical Physics

Volumn 101, Issue 1, 1997, Pages 79-83

  Aydt, E M ^a   Henlschke, R ^a  

^a MAX PLANCK INSTITUTE FOR POLYMER RESEARCH   (Germany)

Author keywords

Adsorption; Computer experiments; Interfaces

Indexed keywords

EID: 0002431033     PISSN: 0940483X     EISSN: None     Source Type: Journal    
DOI: 10.1002/bbpc.19971010110     Document Type: Article

References (21)

1. R. Hentschke, B.L. Schürmann, and J.P. Rabe, J. Chem. Phys. 96, 6213 (1992).
2. R.G. Winkler and R. Hentschke, J. Chem. Phys. 100, 3930 (1994).
3. D. J. Cleaver and D. Tildesley, Mol. Phys. 57, 781 (1994).
4. M. Yoneya and Y. Iwakabe, Langmuir 11, 3516 (1995).
5. B. Smit, J. Phys. Chem. 99, 5597 (1995).
6. J.E. Finn and P.A. Monson, Mol. Phys. 72, 661 (1991).
7. E. Kierlik, M. Rosinberg, J.E. Finn, and P.A. Monson, Mol. Phys. 75, 1435 (1992).
8. R. F. Cracknell, D. Nicholson, and N. Quirke, Mol. Phys. 80, 885 (1993).
9. S. Jiang, K.E. Gubbins, and J.A. Zollweg, Mol. Phys. 80, 103 (1993).
10. J.M. Phillips and C.D. Hruska, Phys. Rev. B39, 5425 (1989).
11. M.J. Bojan, A.V. Vernov, and W.A. Steele, Langmuir 8, 901 (1992).
12. J. Specovius and G. H. Findenegg, Ber. Bunsenges. Phys. Chem. 82, 174 (1978).
13. W.A. Steele, Surf. Sci. 36, 317 (1973).
14. A. Vernov and W.A. Steele, Langmuir 8, 155 (1992).
15. J.H. Dymond and E.B. Smith, The Virial Coefficients of Pure Gases and Mixtures, Clarendon Press, Oxford 1980.
16. J.J. Nicolas, K.E. Gubbins, W.B. Street, and D.J. Tildesley, Mol. Phys. 37, 1429 (1979).
17. R. C. Weast, and M. J. Astle (Eds.) CRC Handbook of Chemistry and Physics. CRC Press, Boca Raton 1981.
18. T.L. Hill, Statistical Mechanics: Principles and Selected Applications, Dover, New York 1956.
19. M.P. Alien, and D.J. Tildesley, Computer Simulation of Liquids, Clarendon Press, Oxford 1990.
20. H.J.C. Berendsen, J.P.M. Postma, W.F. van Gunsteren, A. DiNola, and J.R. Haak, J. Chem. Phys. 81, 3684 (1984).
21. J. Specovius and G.H. Findenegg, Ber. Bunsenges. Phys. Chem. 84, 690 (1980).