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Dissipative particle dynamics: A useful thermostat for equilibrium and nonequilibrium molecular dynamics simulations
Abstract
We discuss dissipative particle dynamics as a thermostat to molecular dynamics, and highlight some of its virtues: (i) universal applicability irrespective of the interatomic potential; (ii) correct and unscreened reproduction of hydrodynamic correlations; (iii) stabilization of the numerical integration of the equations of motion; and (iv) the avoidance of a profile bias in boundary-driven nonequilibrium simulations of shear flow. Numerical results on a repulsive Lennard-Jones fluid illustrate our arguments.
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Cited by
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Karatrantos, A., Clarke, N., Composto, R. J., & Winey, K. I. (2013) · Soft Matter · doi:10.1039/c3sm27651a · Cited by 76
A new coarse grained particle-to-mesh scheme for modeling soft matter
Zhang, G., Daoulas, K. C., & Kremer, K. (2013) · Macromolecular Chemistry and Physics · doi:10.1002/macp.201200520 · Cited by 32
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Metadata
- Authors
- Soddemann, T., Dünweg, B., & Kremer, K.
- Venue
- Physical Review E
- Publisher
- American Physical Society (APS)
- Published
- 2003-10-08
- Volume
- 68
- Issue
- 4
- Pages
- 046702-046702
- ISSN
- 1063-651X (ISSN-L)
- 1095-3787
- OpenAlex
- W2170030737
- Cited by
- 434
- References
- 0
- FWCI
- 7.88
- Type
- journal article
- Language
- en
- Open access
- closed
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- CoChat. (2026). Citation check: Dissipative particle dynamics: A useful thermostat for equilibrium and nonequilibrium molecular dynamics simulations. https://app.cochat.ai/papers/10.1103/physreve.68.046702
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- Soddemann, T., Dünweg, B., & Kremer, K. (2003). Dissipative particle dynamics: A useful thermostat for equilibrium and nonequilibrium molecular dynamics simulations. Physical Review E. https://doi.org/10.1103/physreve.68.046702
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