Heterogeneous nucleation of polymorphs on polymer surfaces: polymer–molecule interactions using a heterogeneous dielectric solvation model
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DOI: 10.1007/s00894-018-3657-0
Abstract: We have investigated the mechanism of the nucleation of acetaminophen on poly(methyl-methacrylate) and poly(vinyl-acetate) utilizing a combination of quantum mechanical computations and electrostatic models. We have used a heterogeneous dielectric solvation model to determine the… read more here.
Keywords: nucleation; polymer surfaces; solvation model; dielectric solvation ... See more keywords