First-principle approach to rescale the dynamics of simulated coarse-grained macromolecular liquids

Physical Review E - Statistical, Nonlinear, and Soft Matter Physics

Volumn 84, Issue 3, 2011, Pages

  Lyubimov, I ^a   Guenza, M G ^a  

^a UNIVERSITY OF OREGON   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BEAD-AND-SPRING MODEL; CENTER-OF-MASS; COARSE GRAINED MODELS; COARSE GRAINING; COARSE-GRAINED; DYNAMICAL RESCALING; FIRST-PRINCIPLE APPROACH; FIRST-PRINCIPLES; FRICTION COEFFICIENTS; GENERALIZED LANGEVIN EQUATION; INTERNAL DEGREES OF FREEDOM; INTERNAL DYNAMICS; LENGTH SCALE; LIOUVILLE EQUATION; MEMORY FUNCTIONS; MESOSCALE SIMULATION; POLYMER DYNAMICS; PROJECTION OPERATOR; PROJECTION OPERATOR TECHNIQUE; RESCALING; SELF-DIFFUSION COEFFICIENTS; SOFT COLLOIDS; SOFT-COLLOIDAL PARTICLES; THERMODYNAMIC PARAMETER; TRANSLATIONAL DIFFUSION;

BROWNIAN MOVEMENT; COLLOIDS; DIFFERENTIAL EQUATIONS; ENTROPY; FRICTION; IMAGE QUALITY; POLYETHYLENES; POLYMER MELTS; THERMOPLASTICS; DEGREES OF FREEDOM (MECHANICS); DIFFUSION IN LIQUIDS;

COMPUTER SIMULATION;

EID: 80052980574     PISSN: 15393755     EISSN: 15502376     Source Type: Journal    
DOI: 10.1103/PhysRevE.84.031801     Document Type: Article

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