메뉴 건너뛰기




Volumn 119, Issue 14, 2003, Pages 7328-7334

Translational diffusion of hydrophobic solutes in supercritical water studied by molecular dynamics simulations

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; DENSITY (SPECIFIC GRAVITY); DIFFERENTIAL EQUATIONS; GRAPH THEORY; HYDRATION; HYDROPHOBICITY; INTEGRAL EQUATIONS; ITERATIVE METHODS; METHANE; OXYGEN; THERMAL EFFECTS; WATER;

EID: 0142242180     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1607953     Document Type: Article
Times cited : (26)

References (75)
  • 13
    • 0142190294 scopus 로고    scopus 로고
    • note
    • In this paper, supercritical water is defined as the water of which temperature is higher than the gas-liquid critical temperature, irrespective of the density.
  • 28
    • 0004242731 scopus 로고    scopus 로고
    • (Cambridge University Press, Cambridge)
    • E. L. Cussler, Diffusion (Cambridge University Press, Cambridge, 1997).
    • (1997) Diffusion
    • Cusller, E.L.1
  • 61
    • 0142252504 scopus 로고    scopus 로고
    • note
    • The estimated error of the diffusion constant from the MSD tends to be smaller than that from the VACF.
  • 62
    • 0142252503 scopus 로고    scopus 로고
    • note
    • o2, because the velocity and the location data of both water and oxygen molecules went through the same routines of our simulation program irrespective of molecular parameters.
  • 63
    • 0031233333 scopus 로고    scopus 로고
    • note
    • It is also to be noted that if the state points are in two-phase separation region, the diffusion constants are not necessarily larger. See the results of the Lennard-Jones fluids; R. L. Rowley and M. M. Painter, Int. J. Thermophys. 18, 1109 (1997).
    • (1997) Int. J. Thermophys. , vol.18 , pp. 1109
    • Rowley, R.L.1    Painter, M.M.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.