Microscopic structure and interaction analysis for supercritical carbon dioxide-ethanol mixtures: A monte carlo simulation study

Journal of Physical Chemistry B

Volumn 113, Issue 14, 2009, Pages 4781-4789

  Xu, Wenhao ^a   Yang, Jichu ^a   Hu, Yinyu ^a  

^a TSINGHUA UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON DIOXIDE; ETHANOL; HYDROGEN; HYDROGEN BONDS; MIXTURES; MOLECULAR STRUCTURE; MONTE CARLO METHODS; OLIGOMERS; PRESSURE EFFECTS; REAL TIME SYSTEMS; THERMAL EFFECTS;

EDA COMPLEXES; ELECTRON DONOR ACCEPTORS; ETHANOL MIXTURES; FORCE FIELDS; HYDROGEN BONDINGS; HYDROGEN-BONDED NETWORKS; INTERACTION ANALYSIS; ISOBARIC-ISOTHERMAL ENSEMBLES; MICROSCOPIC STRUCTURES; MOLE FRACTIONS; MONTE CARLO SIMULATIONS; PENTAMERS; SUPERCRITICAL CARBON DIOXIDES; TETRAMERS; VAPOR LIQUIDS;

SUPERCRITICAL FLUID EXTRACTION;

EID: 65249120913     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp810193b     Document Type: Article

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