耗散颗粒动力学模拟
参数化(大气建模)
纳米技术
耗散系统
软物质
计算机科学
统计物理学
材料科学
胶体
物理
化学
聚合物
热力学
物理化学
复合材料
辐射传输
量子力学
作者
Kolattukudy P. Santo,Alexander V. Neimark
标识
DOI:10.1016/j.cis.2021.102545
摘要
Dissipative particle dynamics (DPD) is one of the most efficient mesoscale coarse-grained methodologies for modeling soft matter systems. Here, we comprehensively review the progress in theoretical formulations, parametrization strategies, and applications of DPD over the last two decades. DPD bridges the gap between the microscopic atomistic and macroscopic continuum length and time scales. Numerous efforts have been performed to improve the computational efficiency and to develop advanced versions and modifications of the original DPD framework. The progress in the parametrization techniques that can reproduce the engineering properties of experimental systems attracted a lot of interest from the industrial community longing to use DPD to characterize, help design and optimize the practical products. While there are still areas for improvements, DPD has been efficiently applied to numerous colloidal and interfacial phenomena involving phase separations, self-assembly, and transport in polymeric, surfactant, nanoparticle, and biomolecules systems.
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