The composition dependence of self and transport diffusivities from molecular dynamics simulations

Chemical Engineering Journal

Volumn 100, Issue 1-3, 2004, Pages 51-69

  Keffer, David J ^a   Adhangale, Parag ^a  

^a University of Tennessee Knoxville   (United States)

Author keywords

Darken equation; Isobaric isothermal; Molecular dynamics; Pressure; Self diffusivity; Temperature; Transport diffusivity

Indexed keywords

COMPOSITION; CORRELATION METHODS; DIFFUSION; EQUATIONS OF STATE; ISOTHERMS; LARGE SCALE SYSTEMS; PRESSURE EFFECTS; SENSITIVITY ANALYSIS; THERMODYNAMICS;

COMPOSITION DEPENDENCE; EMPIRICAL CORRELATIONS; MICROCANONICAL; TRANSPORT DIFFUSIVITY;

MOLECULAR DYNAMICS;

MOLECULAR STRUCTURE;

EOS;

EID: 2442433568     PISSN: 13858947     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cej.2003.11.028     Document Type: Article

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