The sixth industrial fluid properties simulation challenge

Fluid Phase Equilibria

Volumn 310, Issue 1-2, 2011, Pages 1-3

  Case, Fiona H ^a   Chaka, Anne ^b   Moore, Jonathan D ^c   Mountain, Raymond D ^b   Ross, Richard B ^d   Shen, Vincent K ^b   Stahlberg, Eric A ^e  

^a Case Scientific   (United States)

^b NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY   (United States)

^c DOW CHEMICAL COMPANY   (United States)

^d 3M COMPANY   (United States)

^e WITTENBERG UNIVERSITY   (United States)

Author keywords

Computational chemistry; Dipropylene glycol dimethyl ether; Industrial fluid properties simulation challenge; Liquid liquid equilibria; Molecular modeling; Molecular simulation

Indexed keywords

BENCHMARK DATA; DIPROPYLENE GLYCOL DIMETHYL ETHER; DRIVING FORCES; HYDROPHOBIC AND HYDROPHILIC INTERACTIONS; INDUSTRIAL FLUID PROPERTIES SIMULATION CHALLENGE; INDUSTRIAL FLUIDS; LIQUID LIQUID EQUILIBRIUM; MODELING AND SIMULATION METHODS; MOLECULAR SIMULATIONS; MUTUAL SOLUBILITY; NOT GIVEN; PRACTICAL IMPORTANCE; PRIORI KNOWLEDGE; TEMPERATURE DEPENDENT; WATER SYSTEM;

ATMOSPHERIC PRESSURE; COMPUTATIONAL CHEMISTRY; COMPUTER SIMULATION; ETHERS; FORECASTING; FUELS; GLYCOLS; HYDROPHILICITY; INDUSTRY; MOLECULAR MODELING; PROTEIN FOLDING;

LIQUIDS;

EID: 80053384589     PISSN: 03783812     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.fluid.2011.07.016     Document Type: Article

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