Cross-scale numerical simulations using discrete particle models

Molecular Simulation

Volumn 22, Issue 6, 1999, Pages 397-418

  Dzwinel, W ^a   Alda, W ^a   Yuen, D A ^b  

^a AGH UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Poland)

^b UNIVERSITY OF MINNESOTA   (United States)

Author keywords

Cross scale simulations; Dissipative particle dynamics; Molecular dynamics; Parallel implementation; Smoothed particle dynamics

Indexed keywords

EID: 0006253623     PISSN: 08927022     EISSN: None     Source Type: Journal    
DOI: 10.1080/08927029908022107     Document Type: Article

References (24)

1. Alda, W., Dzwinel, W., Kitowski, J., Moscinski, J., Pogoda, M. and Yuen, D. A. (1998). "Complex Fluid-Dynamical Phenomena modeled by Large-Scale Molecular Dynamics Simulation", Computers in Physics, 12(6), will appear in Nov./Dec. issue.
2. Beazley, D. M., Lomdahl, P. S., Gronbech-Jansen, N., Giles, R. and Tomayo, P. (1996). "Parallel Algorithms for Short Range Molecular Dynamics", In: World Scientific's Annual Reviews of Computational Physics III, World Scientific, pp. 119-175.
3. Clementi, E., Chin, S., Corongiu, G., Detrich, J., Dupuis, M., Folsom, D., Lie, G. C., Logan, D., Meck, D. and Sonnad, V. (1986). "Large Scale Computations on Scalar, Vector and Parallel "Supercomputer" and Global ab initio Simulations with a Study on Liquid Water as an Example", IBM Technical Report, KGN 86 (Kingston, New York).
4. Dzwinel, W., Alda, W., Kitowski, J., Moscinski, J., Wcislo, R. and Yuen, D. A. (1995). "Applications of Molecular Dynamics Method for Simulations in Macroscale", Molecular Simulation, 15, 343-360.
5. Dzwinel, W. (1997). "Virtual Particles and search for global minimum", Future Generation Computer Systems, 12, 371-389.
6. Dzwinel, W., Alda, W., Pogoda, M. and Yuen, D. A., "Turbulent Mixing in the Microscale", Physica D, submitted for publication (also in Minnesota Supercomputing Institute Research Report, UMSI 98/167, September 1998).
7. Español, P. (1998). "Fluid Particle Model", Physical Review E, 57(3), 2930-2948.
8. Finn, R. (1996). "Exploring Materials in a Simulated World", IBM Research, 1, 16-19.
9. Galperin, B. and Orszag, S. A. (Eds.) (1993). Large Eddy Simulation of Complex Engineering and Geophysical Flows, Cambridge Univ. Press.
10. Hadjiconstantinou, N. G. and Patera, A. T. (1997). "Heterogeneous atomistic-continuum representation for dense fluid systems", Int. Journal of Modern Physics C, 8(4), 967-976.
11. Hadjiconstantinou, N., Hybrid Atomistic-Continuum Formulations and the Moving Contact Line Problem, Ph.D. Thesis, Department of Mechanical Engineering, MIT, September 1998.
12. Hoogerbrugge, P. J. and Koelman, J. M. V. A. (1992). "Simulating Micrscopic Hydrodynamic Phenomena with Dissipative particle Dynamics", Europhysics Letters, 19(3), 155-160.
13. Holian, B. L. and Ravelo, R. (1995). "Fracture Simulation Using Large-Scale Molecular Dynamics, Phys. Rev. B., 51(17), 11275-11285.
14. Koplik, J. and Banavar, J. R. (1998). "Physics of Fluids at Low Reynolds Numbers - A Molecular Approach", Computers in Physics, 12(5), 424-431.
15. Libersky, L. D., Petschek, A. G., Carney, T. C., Hipp, J. R. and Allahdadi, F. A. (1993). "High Strain Lagrangian Hydrodynamic", Journal of Computational Physics, 109(1), 67-73.
16. Lomdahl, P. S. and Beazley, D. M. (1994). "State of the Art. Parallel Computing", Los Alamos Science, 22, 44-57.
17. Monaghan, J. J. (1992). "Smoothed Particle Hydrodynamics", Annu. Rev. Astron. Astrophys., 30(30), 543.
18. Mościński, J., Alda, W., Bubak, M., Dzwinel, W., Kitowski, J., Pogoda, M. and Yuen, D. A. (1997). "Molecular Dynamics Simulation of Rayleigh-Taylor Instability", Annual Reviews of Computational Physics V, World Scientific, pp. 97-136.
19. Novik, K. E. and Coveney, P. V. (1997). "Using Dissipative Particle Dynamics to Model Binary Immiscible Fluids", International Journal of Modern Physics C, 8, 909-915.
20. Ristow, G. H. (1994). "Granular dynamics: a review about recent molecular dynamics simulations of granular materials", Annual Reviews of Computational Physics I, World Scientific.
21. Rothman, D. H. and Zaleski, S. (1994). "Lattice gas models of phase separation: interfaces, phase transitions, and multiphase flow", Rev. of Mod. Phys., 66(4), 1417-1479.
22. Vashishta, P., "Multimilion Atom Molecular Dynamics Simulations of High Temperature Ceramics on Parallel Computers", Concurrent Computing Laboratory for Materials Simulations, Louisiana State University, http://www.cclms.lsu.edu.
23. Yuen, D. A. and Rustad, J., Workshop on Computational Studies of Interfacial Phenomena: Nanoscale to Mesoscale, Pacific Northwest National Lab (PNNL), September 24-25, 1998 Richland, Washington, http://banzai. msi.umn.edu/mel/workshop.html
24. 7th International Conference on the Discrete Simulation of Fluids, University of Oxford, 14th-18th July 1998. http://www-thphys.physics.ox.ac.uk/users/Julia Yeomans/conf/ prong 1. html