Analysis of traction properties of fluids using molecular dynamics simulations (Part 1): Determination of appropriate simulation conditions

Japanese Journal of Tribology

Volumn 51, Issue 6, 2006, Pages 701-710

  Washizu, Hitoshi ^a   Sanda, Shuzo ^a   Ohmori, Toshihide ^a   Suzuki, Atsushi ^b  

^a Rd Management Section   (Japan)

^b TOYOTA MOTOR CORPORATION   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; HYDROCARBONS; MOLECULAR DYNAMICS; TRACTION (FRICTION); VISCOELASTICITY;

EID: 36448988979     PISSN: 10457828     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (22)

1. K. Hata and T. Tsubouchi, "Development of Traction Oils for Half-Toroidal CVT," Surface Engineering (in Japanese), 24, 6 (2003), p. 351.
2. T. Tsubouchi and K. Hata, "Traction Fluids," Journal of Japan Society of Tribologist, 42, 3 (1997), p. 193.
3. D. Dowson and G.R. Higginson, Elastohydrodynamics Lubrication, Pergaman Press (1966).
4. C.R. Evans and K.L. Johnson, "Regimes of Traction in Elastohydrodynamics Lubrication", Proc. Instn. Mech. Engrs., 200 (1986), p. 313.
5. H. Nakamura, "High-Pressure Viscosity and Traction Characteristics," Journal of Japan Society of Tribologist, 46, 5 (2001), p. 368.
6. M. Muraki, "Elastohydrodynamic Lubrication and Traction Characteristics," Journal of Japan Society of Tribologist, 46, 5 (200 1), p. 355.
7. F.F. Abraham, "The Interfacial Density Profile of a Lennard-Jones Fluid in Contact with a (100) Lennard-Jones Wall and its Relationship to Idealized Fluid/Wall Systems: A Monte Carlo Simulation," J. Chem. Phys., 68, 8, (1978) 3713.
8. P.A. Thomson and M.O. Robbins, "Shear Flow Near Solids: Epiaxial Order and Flow Boundary Conditions," Phys. Rev. A., 41, 12, (1990), 6830.
9. P.A. Thomson, G.S. Crest and M.O. Robbins, "Phase Transitions and Universal Dynamics in Confined Films," Phys. Rev. Lett., 68, 23, (1992), 3448.
10. S.A. Gupta, H.D. Cochran and P.T. Cummings, "Shear Behavior of Squalane and Tetracosane under Extreme Confinement. 1. Model, Simulation Method, and Interfacial Slip," J. Phys. Chem., 107, 23 (1997), p. 10316.
11. S.T. Cui, P.T. Cummings and H.D. Cochran, "Molecular Dynamics Simulation of the Rheological and Dynamical Properties of a Model Alkane Fluid Under Confinement," J. Chem. Phys., 111, 3 (1999), p. 1273.
12. H. Tamura, M. Yoshida, K. Kusakabe, C. Young-Mo, R. Miura, M. Kubo, K. Teraishi, A. Chatterjee, and A. Miyamoto, "Molecular Dynamics Simulations of Friction of Hydrocarbon Thin Films," Langmuir, 15 (1999), 7816.
13. H. Yamano, K. Shiota, R. Miura, M. Katagiri, M. Kubo, A. Stirling, E. Broclawik, A. Miyamoto, and T. Tsubouchi, "Moleucular Dynamics Simulations of Traction Fluid Molecules under EHL Condition," Thin Solid Films, 282 (1996) 598.
14. H. Tamura and A. Miyamoto, "Behavioral analysis of lubricants by molecular dynamic method," Journal ofJapan Society of Tribologists, 45, 9 (2000), p. 655.
15. M.L. Greenfield and H. Ohtani, "Molecular Dynamics Simulation Study of Model Friction Modifier Additives Confined Between Two Surfaces," Tribology Lett., 7 (1999), p. 137.
16. S. Okumura, J. Sugimura and Y. Yamamoto, "Effect of Surface Roughness on Behavior of Lubricant Molecules in Ultra-Thin Lubricant Film," Journal of Japan Society of Tribologist, 48, 10 (2003); p. 836.
17. S. Bair, C. McCabe and P.T. Cummings, "Comparison of Nonequilibrium Molecular Dynamics with Experimental Measurements in the Nonlinear Shear-thinning Regime," Phys. Rev. Lett. 88, 5 (2002) 058302.
18. W.D. Cornell, P. Cieplak, C.I. Bayly, I.R. Gould, K.M. Merz, Jr., D.M. Ferguson, D.C. Spellmeyer, T. Fox, J.W. Caldwell, and P.A. Kollman, "A Second Generation Force Field for the Simulation of Proteins and Nucleic acids," J. Am. Chem. Soc., 117 (19995), p. 5179.
19. Nosé, "A Unified Formulation of the Constant-Temperature Molecular Dynamics Methods,". J. Chem. Phys., 81 (1984), p. 511.
20. M. Tuckerman, B.J. Berne and G.J. Martyna, "Reversible Multiple Time Scale Molecular-Dynamics," J. Chem. Phys., 97, 3 (1992), p. 1990.
21. M. Komeji: Biomolecular Simulation by PEACH, (1): Principles and Method, 3rd ed., Research Institute of Technology (2000).
22. M.J. Stevens, M. Mondello, G.S. Crest, S.T. Cui, H.D. Cochran, and P.T. Cummings, "Comparision of Shear Flow of Hexadecane in a Confined Geometry and in Bulk," J. Chem. Phys., 106, 17 (1997), p. 7303.