Liquid properties of tetrahydrofuran and methylene chloride via the molecular hypernetted chain approximation
Article Abstract:
Research was conducted to examine the liquid properties of tetrahydrofuran and methylene chloride via the molecular hypernetted chain approximation. The internal energies and the dielectric constants of two useful solvents of low permittivity were calculated using the approximation of the molecular Ornstein-Zernike theory. Results for methylene chloride, using a site-site interaction model, are in good agreement with experimental results provided that the polarizability is considered in a self-consistent way.
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 1998
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Protic ionic liquids: Preparation, characterization, and proton free energy level representation
Article Abstract:
The relations between inorganic and organic cation ionic liquids (ILs) and the synthesis and properties of a large number of an intermediate group of liquids are discussed. The energy level schemes have verified the relation between solvent-free acidic and basic electrolytes and the familiar aqueous variety and have identified neutral protic electrolytes that are unavailable in the case of aqueous systems.
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2007
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Application of the hypernetted chain approximation to the electrical double layer for 2:1 and 1:2 electrolytes
Article Abstract:
The equations needed to estimate the potential drop across the diffuse layer according to the hypernetted chain approximation (HNCA) are derived for 2:1 and 1:2 electrolytes at the restricted primitive level. HNCA results can be expressed in the same format as Guoy-Chapman equations with inclusion of two modified functions.
Publication Name: Journal of Physical Chemistry B
Subject: Chemicals, plastics and rubber industries
ISSN: 1520-6106
Year: 2005
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