Optimization of Coarse-Grained Interaction Potential: Inside Inherent Limitations of Coarse-Graining Methods

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Optimization of Coarse-Grained Interaction Potential: Inside Inherent Limitations of Coarse-Graining Methods

We studied the inherent limitations of coarse-grained (CG) potentials within the recently developed approach (Kowalczyk et al. J. Phys. Chem. B2009, 113, 12988–12998). For all studied fluids, the spherically symmetric CG potential constructed according to our scheme modified in this work balances th...

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Bibliographic Details
Main Authors:	Kowalczyk, Piotr, Gauden, P., Ciach, A.
Format:	Journal Article
Published:	American Chemical Society 2011
Online Access:	http://hdl.handle.net/20.500.11937/29047

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