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Self-diffusion coefficient in smoothed dissipative particle dynamics.
J Chem Phys 2009; 130(2):021101JC

Abstract

Smoothed dissipative particle dynamics (SDPD) is a novel coarse grained method for the numerical simulation of complex fluids. It has considerable advantages over more traditional particle-based methods. In this paper we analyze the self-diffusion coefficient D of a SDPD solvent by using the strategy proposed by Groot and Warren [J. Chem. Phys. 107, 4423 (1997)]. An analytical expression for D in terms of the model parameters is developed and verified by numerical simulations.

Authors+Show Affiliations

Lehrstuhl für Aerodynamik, Technische Universität München, 85747 Garching, Germany.No affiliation info availableNo affiliation info availableNo affiliation info available

Pub Type(s)

Journal Article

Language

eng

PubMed ID

19154012

Citation

Litvinov, Sergey, et al. "Self-diffusion Coefficient in Smoothed Dissipative Particle Dynamics." The Journal of Chemical Physics, vol. 130, no. 2, 2009, p. 021101.
Litvinov S, Ellero M, Hu X, et al. Self-diffusion coefficient in smoothed dissipative particle dynamics. J Chem Phys. 2009;130(2):021101.
Litvinov, S., Ellero, M., Hu, X., & Adams, N. A. (2009). Self-diffusion coefficient in smoothed dissipative particle dynamics. The Journal of Chemical Physics, 130(2), p. 021101. doi:10.1063/1.3058437.
Litvinov S, et al. Self-diffusion Coefficient in Smoothed Dissipative Particle Dynamics. J Chem Phys. 2009 Jan 14;130(2):021101. PubMed PMID: 19154012.
* Article titles in AMA citation format should be in sentence-case
TY - JOUR T1 - Self-diffusion coefficient in smoothed dissipative particle dynamics. AU - Litvinov,Sergey, AU - Ellero,Marco, AU - Hu,Xiangyu, AU - Adams,Nikolaus A, PY - 2009/1/22/entrez PY - 2009/1/22/pubmed PY - 2009/1/22/medline SP - 021101 EP - 021101 JF - The Journal of chemical physics JO - J Chem Phys VL - 130 IS - 2 N2 - Smoothed dissipative particle dynamics (SDPD) is a novel coarse grained method for the numerical simulation of complex fluids. It has considerable advantages over more traditional particle-based methods. In this paper we analyze the self-diffusion coefficient D of a SDPD solvent by using the strategy proposed by Groot and Warren [J. Chem. Phys. 107, 4423 (1997)]. An analytical expression for D in terms of the model parameters is developed and verified by numerical simulations. SN - 1089-7690 UR - https://www.unboundmedicine.com/medline/citation/19154012/Self_diffusion_coefficient_in_smoothed_dissipative_particle_dynamics_ L2 - https://dx.doi.org/10.1063/1.3058437 DB - PRIME DP - Unbound Medicine ER -