Article
Formal derivation of dissipative particle dynamics from first principles
Author/s | Cubero Gómez, David
![]() ![]() ![]() ![]() ![]() ![]() ![]() Yaliraki, Sophia N. |
Department | Universidad de Sevilla. Departamento de Física Aplicada I |
Publication Date | 2005 |
Deposit Date | 2015-06-05 |
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Abstract | We show that the Markovian approximation assumed in current particle-based coarse-grained techniques, like dissipative particle dynamics, is unreliable in situations in which sound plays an important role. As an example ... We show that the Markovian approximation assumed in current particle-based coarse-grained techniques, like dissipative particle dynamics, is unreliable in situations in which sound plays an important role. As an example we solve analytically and numerically the dynamics of coarse-grained harmonic systems by using first principle methods, showing the presence of long-lived memory kernels. This effect raises questions about the connection of these approaches at their current form to molecular dynamics. |
Funding agencies | European Union (UE) |
Citation | Cubero Gómez, D. y Yaliraki, S.N. (2005). Formal derivation of dissipative particle dynamics from first principles. Physical Review E, 72 (3), 032101-1-4. |
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