Massively parallel Wang-Landau sampling on multiple GPUs

Computer Physics Communications

Volumn 183, Issue 8, 2012, Pages 1568-1573

  Yin, Junqi ^a,b   Landau, D P ^a  

^a UNIVERSITY OF GEORGIA   (United States)

^b OAK RIDGE NATIONAL LABORATORY   (United States)

Author keywords

GPU computing; Phase transition; Wang Landau sampling; Water clusters

Indexed keywords

COMPUTE UNIFIED DEVICE ARCHITECTURES; FAST CONVERGENCE; GPU COMPUTING; GRAPHICS PROCESSING UNIT; WANG-LANDAU SAMPLING; WATER CLUSTER;

COMPUTER GRAPHICS; PHASE TRANSITIONS; PROGRAM PROCESSORS;

COMPUTER GRAPHICS EQUIPMENT;

EID: 84860304107     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2012.02.023     Document Type: Article

References (43)

1. F.G. Wang, and D.P. Landau Phys. Rev. Lett. 86 2001 2050
2. F.G. Wang, and D.P. Landau Phys. Rev. E 64 2001 056101
3. D.P. Landau, S.-H. Tsai, and M. Exler Amer. J. Phys. 72 2004 1294
4. M.S. Shell, P.G. Debenedetti, and A.Z. Panagiotopoulos Phys. Rev. E 66 2002 056703
5. Q. Yan, and J.J. de Pablo Phys. Rev. Lett. 90 2003 035701
6. M. Troyer, S. Wessel, and F. Alet Phys. Rev. Lett. 90 2003 120201
7. F. Rampf, W. Paul, and K. Binder Europhys. Lett. 70 2005 628
8. D.F. Parsons, and D.R.M. Williams J. Chem. Phys. 124 2006 221103
9. C.G. Zhou, T.C. Schulthess, S. Torbrugge, and D.P. Landau Phys. Rev. Lett. 96 2006 120201
10. C.G. Zhou, T.C. Schulthess, and D.P. Landau J. Appl. Phys 99 2006 08H906
11. T. Wust, and D.P. Landau Phys. Rev. Lett. 102 2009 178101
12. C. Desgranges, and J. Delhommelle J. Chem. Phys. 120 2009 244109
13. D.T. Seaton, T. Wuest, and D.P. Landau Phys. Rev. E 81 2010 011802
14. F. Lou, and P. Clote Bioinformatics 26 2010 i278
15. T. Hoppe, and J. Yuan J. Phys. Chem. B 115 2011 2006
16. M. Eisenbach, D.M. Nicholson, A. Rusanu, and G. Brown J. Appl. Phys. 109 2011 07E138
17. B.A. Berg, and T. Neuhaus Phys. Lett. B 267 1991 249
18. B.A. Berg, and T. Neuhaus Phys. Rev. Lett. 68 1992 9
19. B.A. Berg Int. J. Mod. Phys. C 3 1992 1083
20. L. Zhan Comput. Phys. Comm. 179 2008 339
21. M. Eisenbach, C.-G. Zhou, D.M. Nicholson, G. Brown, J. Larkin, T.C. Schulthess, in: SC, Portland, Oregon, USA, November 14-20, 2009, ACM, New York.
22. T. Preis, P. Virnau, W. Paul, and J.J. Schneider J. Comp. Phys. 228 2009 4468
23. B. Block, P. Virnau, and T. Preis Comput. Phys. Comm. 181 2010 1549
24. J. Yin, and D.P. Landau Phys. Rev. E 80 2009 051117
25. J. Yin, and D.P. Landau Phys. Rev. E 81 2010 031121
26. M. Bernaschi, G. Parisi, and L. Parisi Comput. Phys. Comm. 182 2011 1265
27. M. Weigel Comput. Phys. Comm. 182 2011 1833
28. E.E. Ferrero, J.P.D. Francesco, N. Wolovick, and S.A. Cannas arXiv:1101.0876
29. E.E. Ferrero, J.P.D. Francesco, N. Wolovick, S.A. Cannas, and M. Weigel J. Comp. Phys. 231 2012 3064
30. W.L. Jorgensen J. Amer. Chem. Soc. 103 1981 335
31. W.L. Jorgensen J. Chem. Phys. 77 1982 4156
32. C.J. Tsai, and K.D. Jordan J. Chem. Phys. 95 1991 3850
33. J.M. Pedulla, and K.D. Jordan Chem. Phys. 239 1998 593
34. A.N. Tharrington, and K.D. Jordan J. Phys. Chem. A 107 2003 7380
35. G. Ganzenmüller, and P.J. Camp J. Chem. Phys. 127 2007 154504
36. J. Yin, and D.P. Landau J. Chem. Phys. 134 2011 074501
37. W. Press, S. Teukolsky, W. Vetterling, and B. Flannery Numerical Recipes in C 1992 Cambridge University Press NY, USA
38. M. Matsumoto, and T. Nishimura ACM Trans. Modeling Comput. Simulations 8 1998 3
39. M. Matsumoto, and T. Nishimura Monte Carlo and Quasi-Monte Carlo Methods 2000 Springer 56 pp
40. V. Podlozhnyuk, Parallel Mersenne Twister, NVIDIA CUDA SDK 1.0, 2007.
41. W. Kahan Comm. ACM 8 1965 40
42. S. Trebst, D.A. Huse, and M. Troyer Phys. Rev. E 70 2004 046701
43. NVIDIA Corporation, NVIDIA CUDA Programming Guide, version 3.1.1, 2010.