scholarly journals Universal shape characteristics for the mesoscopic polymer chain via dissipative particle dynamics

2016 ◽  
Vol 28 (50) ◽  
pp. 505101 ◽  
Author(s):  
O Kalyuzhnyi ◽  
J M Ilnytskyi ◽  
Yu Holovatch ◽  
C von Ferber
Symmetry ◽  
2020 ◽  
Vol 12 (3) ◽  
pp. 397 ◽  
Author(s):  
Ramin Zakeri ◽  
Moslem Sabouri ◽  
Akbar Maleki ◽  
Zahra Abdelmalek

In this paper, the effect of Magneto Hydro-Dynamics (MHD) on a polymer chain in the micro channel is studied by employing the Dissipative Particle Dynamics simulation (DPD) method. First, in a simple symmetric micro-channel, the results are evaluated and validated for different values of Hartmann (Ha) Number. The difference between the simulation and analytical solution is below 10%. Then, two types of polymer chain including short and long polymer chain are examined in the channel and the effective parameters such as Ha number, the harmony bond coefficient or spring constant (K), and the length of the polymer chain (N) are studied in the MHD flow. It is shown that by increasing harmony bond constant to 10 times with Ha = 20, the reduction of about 80% in radius of gyration squared, and half in polymer length compared to Ha = 1 would occur for both test cases. For short and long length of polymer, proper transfer of a polymer chain through MHD particles flow is observed with less perturbations (80%) and faster polymer transfer in the symmetric micro-channel.


Author(s):  
Masoud Darbandi ◽  
Ramin Zakeri ◽  
Gerry E. Schneider

In this study, we simulate the motion and reformation of polymer chain in the nanoscale fluid flow motion of the DPD (Dissipative Particle Dynamics) solvent. The behavior of polymer chain through DPD solvent is studied for 2D and 3D considerations. We implement two body forces of Poiseuille flow and electroosmotic flow to the DPD fluid particles. In case of the electroosmotic flow force, we show that the movement of polymer chain via the electroosmotic phenomenon provides less dispersion than that of the Poiseuille flow for the same polymer chain movement.


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