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Volumn 33, Issue 1-2, 2007, Pages 65-69

Molecular dynamics simulations of structure-H hydrates formed with methane and 3,3-dimethylpentane or 2,2-dimethylpentane

Author keywords

Dimethylpentane; Hydrates; Methane; Molecular dynamics; Structure H; Water

Indexed keywords

COMPUTER SIMULATION; METHANE; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; WATER;

EID: 33947395644     PISSN: 08927022     EISSN: 10290435     Source Type: Journal    
DOI: 10.1080/08927020601059885     Document Type: Conference Paper
Times cited : (5)

References (11)
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    • Free-energy calculation of structure-H hydrates
    • Y. Okano, K. Yasuoka. Free-energy calculation of structure-H hydrates. J. Chem. Phys., 124, 024510 (2006).
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    • Okano, Y.1    Yasuoka, K.2
  • 4
    • 0021515659 scopus 로고
    • Optimized inter-molecular potential functions for liquid hydrocarbons
    • W.L. Jorgensen, J.D. Madura, C.J. Swenson. Optimized inter-molecular potential functions for liquid hydrocarbons. J. Am. Chem. Soc., 106, 6638 (1984).
    • (1984) J. Am. Chem. Soc , vol.106 , pp. 6638
    • Jorgensen, W.L.1    Madura, J.D.2    Swenson, C.J.3
  • 5
    • 0028516829 scopus 로고
    • Structure H hydrate phase equilibria of paraffins, naphthenes, and olefins with methane
    • A.P. Metha, E.D. Sloan, Structure H hydrate phase equilibria of paraffins, naphthenes, and olefins with methane. J. Chem. Eng. Data., 39, 887 (1994).
    • (1994) J. Chem. Eng. Data , vol.39 , pp. 887
    • Metha, A.P.1    Sloan, E.D.2
  • 9
    • 33646940952 scopus 로고
    • Numerical integration of the Cartesian equations of motion of a system with constraints: Molecular dynamics of n-alkanes
    • J.P. Ryckaert, G. Ciccotti, H.J.C. Berendsen. Numerical integration of the Cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes. J. Comput. Phys., 23, 327 (1977).
    • (1977) J. Comput. Phys , vol.23 , pp. 327
    • Ryckaert, J.P.1    Ciccotti, G.2    Berendsen, H.J.C.3
  • 10
    • 36749107785 scopus 로고
    • Molecular dynamics at constant pressure and/or temperature
    • H.C. Andersen. Molecular dynamics at constant pressure and/or temperature. J. Chem. Phys., 72, 2384 (1980).
    • (1980) J. Chem. Phys , vol.72 , pp. 2384
    • Andersen, H.C.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.