Parametrisation in electrostatic DPD Dynamics and Applications
E. Mayoral, E. Nahmad-Achar
TL;DR
This paper reviews mesoscopic dissipative particle dynamics modeling, focusing on parameter determination for realistic systems, including how parameters depend on concentration and temperature, and discusses various applications.
Contribution
It provides a comprehensive overview of parametrisation methods in electrostatic DPD and explores their dependence on physical conditions and practical applications.
Findings
Parameter calculation methods for realistic systems
Dependence of parameters on concentration and temperature
Applications of electrostatic DPD modeling
Abstract
A brief overview of mesoscopic modelling via dissipative particle dynamics is presented, with emphasis on the appropriate parametrisation and how to calculate the relevant parameters for given realistic systems. The dependence on concentration and temperature of the interaction parameters is also considered, as well as some applications.
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Taxonomy
TopicsBlock Copolymer Self-Assembly · Material Dynamics and Properties · Nanopore and Nanochannel Transport Studies