Hybrid approach combining dissipative particle dynamics and finite-difference diffusion model: Simulation of reactive polymer coupling and interfacial polymerization

Journal of Chemical Physics

Volumn 139, Issue 15, 2013, Pages

  Berezkin, Anatoly V ^a   Kudryavtsev, Yaroslav V ^b  

^a MAX PLANCK INSTITUT FÜR EISENFORSCHUNG GMBH   (Germany)

^b TOPCHIEV INSTITUTE OF PETROCHEMICAL SYNTHESIS   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

DIFFUSION-CONTROLLED REGIME; DISSIPATIVE PARTICLE DYNAMICS; END-FUNCTIONALIZED POLYMERS; INTERFACIAL POLYMERIZATION; KINETICS AND MECHANISM; LIQUID/LIQUID INTERFACE; SELF-CONSISTENT PROCEDURES; SOLUTE CONCENTRATIONS;

DIFFUSION; FINITE DIFFERENCE METHOD; PARTIAL DIFFERENTIAL EQUATIONS; PHASE SEPARATION; POLYMERIZATION; POLYMERS;

COMPUTER SIMULATION;

POLYMER; SOLVENT;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; DIFFUSION; KINETICS; MOLECULAR DYNAMICS; PARTICLE SIZE; POLYMERIZATION; SURFACE PROPERTY; SYNTHESIS;

DIFFUSION; KINETICS; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; PARTICLE SIZE; POLYMERIZATION; POLYMERS; SOLVENTS; SURFACE PROPERTIES;

EID: 84886523318     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4824768     Document Type: Article

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