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Model calculations of the phase-behaviour of rod-like particles in solution and their application to the isotropic and anisotropic phases of poly(n-alkylisocyanates) in solution

โœ Scribed by Josef K. Moscicki; Graham Williams


Publisher
Elsevier Science
Year
1981
Tongue
English
Weight
268 KB
Volume
22
Category
Article
ISSN
0032-3861

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## Abstract A general formalism for the calculation of cavitation energies in the framework of the scaled particle theory has been implemented in the Polarizable Continuum Model (PCM), contributing to the nonelectrostatic part of the molecular free energy in solution. The solute cavity and the solv