A refined ring polymer contraction scheme for systems with electrostatic interactions

We have recently shown how path integral simulations can be streamlined by decomposing the potential into a sum of rapidly-varying short-range and slowly-varying long-range contributions. Here, we introduce an efficient way to perform this decomposition for systems with electrostatic interactions an...

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Detaylı Bibliyografya
Asıl Yazarlar: Markland, T, Manolopoulos, D
Materyal Türü: Journal article
Dil:English
Baskı/Yayın Bilgisi: 2008