Liquid-liquid equilibria of dipropylene glycol dimethyl ether and water by molecular dynamics

Fluid Phase Equilibria

Volumn 310, Issue 1-2, 2011, Pages 25-31

  Köddermann, Thorsten ^a   Kirschner, Karl N ^a   Vrabec, Jadran ^b   Hülsmann, Marco ^a   Reith, Dirk ^a  

^a FRAUNHOFER INSTITUTE FOR ALGORITHMS AND SCIENTIFIC COMPUTING SCAI   (Germany)

^b UNIVERSITY OF PADERBORN   (Germany)

Author keywords

Ether; Force field parameterization; Liquid liquid equilibria; Molecular dynamics; Water

Indexed keywords

COEXISTING PHASIS; DIMETHYL ETHERS; FORCE FIELD PARAMETERIZATION; FORCE FIELDS; INDUSTRIAL FLUIDS; LIQUID LIQUID EQUILIBRIUM; LIQUID-LIQUID EQUILIBRIA; MOLAR FRACTIONS; MOLECULAR DYNAMICS SIMULATIONS; TEMPERATURE RANGE; WATER MODELS;

DYNAMICS; ETHERS; FUELS; GLYCOLS; MOLECULAR DYNAMICS; ORGANIC COMPOUNDS; WATER;

LIQUIDS;

EID: 80053386503     PISSN: 03783812     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.fluid.2011.07.015     Document Type: Article

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