Molecular simulation and modeling of the phase equilibria of polar compounds.
The initial phase of the project involved an investigation into the modeling of binary carboxylic acid vapour-liquid equilibrium (VLE) data. This stemmed from the Masters research that led into the current study, in which the conventional gamma-phi formulation of VLE was found to inadequately descri...
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Language: | en |
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2010
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Online Access: | http://hdl.handle.net/10413/1540 |