May 10, 2013 · Fine-graining without coarse-graining: an easy and fast way to equilibrate dense polymer melts . Faraday Discuss 2010, 144: 25–42. 10.1039 ...
Similar Items. Fine-graining without coarse-graining: an easy and fast way to equilibrate dense polymer melts by: Paola Carbone Published: (2010); Coarse ...
2010: Fine-graining without coarse-graining: an easy and fast way to equilibrate dense polymer melts Faraday Discussions 144: 25-42; Discussion: 93-110, 467 ...
The module is an implementation of the existing hierarchical strategy [1] for the equilibration of simple one-component polymer melts in ESPResSO++. Purpose of ...
Coarse-grained (CG) models have to be used instead, where each polymer segment represents, for example, the center-of-mass of a group of consecutive monomers on ...
When compared to the atomistic simulation results, the CG models reproduced a variety of properties, including the melting point and liquid structures over a ...
Jan 15, 2023 · Fine- · graining without coarse-graining: An easy and fast way to equilibrate · dense polymer melts. Faraday Discuss. 2010, 144, 25. (135) ...
that follow the slow dynamics of the system will not easily lead to complete equilibration of the ... equilibrated polymer melts using MD simulations. Based on ...
Feb 1, 2023 · Fine-graining without coarse-graining: An easy and fast way to equilibrate dense polymer melts. ,”. Faraday Discuss. 144. ,. 25. (. 2010. ).
Dec 12, 2022 · ... polymer interactions heavily affects the viscoelastic properties of the polymer matrix. Furthermore, a dense bead–spring polymer melt was ...
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