Abstract
A brief review is presented of the scaling of complex fluids, polymers and polyelectrolytes in solution and in confined geometry, in thermodynamical, structural and rheology properties using equilibrium and non-equilibrium dissipative particle dynamics simulations. All simulations were carried out on high performance computational facilities using parallelized algorithms, solved on computers using both central and graphical processing units. The scaling approach is shown to be a unifying axis around which general trends and basic knowledge can be gained, illustrated through a series of case studies.
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Acknowledgments
The author wishes to thank his collaborators, with whom most of the results reported here were obtained, in particular: F. Alarcón, S. J. Alas Guardado, M. A. Balderas Altamirano, J. Barroso – Flores, R. Catarino Centeno, J. S. Hernández Fragoso, J. D. Hernández Velázquez, J. Klapp, R. López – Esparza, R. López – Rendón, E. Mayoral, S. Mejía – Rosales, C. Pastorino, R. Patiño Herrera, E. Pérez, G. Pérez – Hernández, Z. Quiñones, E. Rivera – Paz, K. A. Terrón – Mejía, J. Vallejo and M. A. Waldo. Educational discussions with E. Blokhuis and I. Sokolov are also gratefully acknowledged. For computational resources the author is indebted to ABACUS, where some calculations were run; to the high performance cluster Yoltla at UAM – Iztapalapa; to Universidad de Sonora for access to the Ocotillo cluster at their High Performance Computational Area; to the CNS supercomputing facilities at IPICyT, to the Olinka cluster at UAEM, and to the Laboratorio Nacional de Caracterización de Propiedades Fisicoquímicas y Estructura Molecular Supercómputo Universidad de Guanajuato. For technical support at the IFUASLP, J. Limón is also acknowledged. This work was supported in part by project Proinnova – CONACYT, through grant 231810.
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Gama Goicochea, A. (2017). Scaling Properties of Soft Matter in Equilibrium and Under Stationary Flow. In: Barrios Hernández, C., Gitler, I., Klapp, J. (eds) High Performance Computing. CARLA 2016. Communications in Computer and Information Science, vol 697. Springer, Cham. https://doi.org/10.1007/978-3-319-57972-6_22
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DOI: https://doi.org/10.1007/978-3-319-57972-6_22
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