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Volumn 37, Issue 1, 2010, Pages 1-13

Hybrid diffusion: An efficient method for kinetic temperature calculation in molecular dynamics simulations of confined lubricant films

Author keywords

Boundary lubrication; Nanotribology; Viscosity

Indexed keywords

ATOMIC VELOCITIES; ATOMIC VIBRATION; BOUNDARY LUBRICATION; BOUNDARY LUBRICATIONS; CLASSICAL APPROACH; DYNAMIC ASPECTS; EFFICIENT METHOD; ENERGETIC ANALYSIS; KINETIC TEMPERATURES; LUBRICANT FILMS; MEAN ENERGY; MICROSCOPIC POINTS; MICROSCOPIC SCALE; MOLECULAR DYNAMICS SIMULATIONS; NON EQUILIBRIUM; TEMPERATURE PROFILES; THERMAL AGITATION; THERMAL VIBRATION; TIGHTLY-COUPLED; TRANSPORT PHENOMENA; VELOCITY PROFILES; VISCOSITY PREDICTION;

EID: 73349122601     PISSN: 10238883     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11249-009-9484-9     Document Type: Article
Times cited : (12)

References (25)
  • 1
    • 36749118050 scopus 로고
    • Solvation forces in simple dense fluids
    • 10.1063/1.439489 1:CAS:528:DyaL3cXitVertLg%3D 1980JChPh.72.2907S
    • IK Snook W van Megen 1980 Solvation forces in simple dense fluids J. Chem. Phys. 72 2907 2913 10.1063/1.439489 1:CAS:528:DyaL3cXitVertLg%3D 1980JChPh..72.2907S
    • (1980) J. Chem. Phys. , vol.72 , pp. 2907-2913
    • Snook, I.K.1    Van Megen, W.2
  • 2
    • 0000520532 scopus 로고
    • Forces between surfaces in liquids
    • 10.1126/science.241.4867.795 1:CAS:528:DyaL1cXlslKqsbY%3D 17829174 1988Sci.241.795I
    • JN Israelachvili PM McGuiggan 1988 Forces between surfaces in liquids Science 241 4867 795 800 10.1126/science.241.4867.795 1:CAS:528: DyaL1cXlslKqsbY%3D 17829174 1988Sci...241..795I
    • (1988) Science , vol.241 , Issue.4867 , pp. 795-800
    • Israelachvili, J.N.1    McGuiggan, P.M.2
  • 3
    • 0642371520 scopus 로고
    • Liquid to solid like transitions of molecularly thin films under shear
    • 10.1063/1.459067 1:CAS:528:DyaK3cXlt1WnsLY%3D 1990JChPh.93.1895G
    • ML Gee PM McGuiggan JN Israelachvili AM Homola 1990 Liquid to solid like transitions of molecularly thin films under shear J. Chem. Phys. 93 1895 1906 10.1063/1.459067 1:CAS:528:DyaK3cXlt1WnsLY%3D 1990JChPh..93.1895G
    • (1990) J. Chem. Phys. , vol.93 , pp. 1895-1906
    • Gee, M.L.1    McGuiggan, P.M.2    Israelachvili, J.N.3    Homola, A.M.4
  • 4
    • 0000728761 scopus 로고
    • Motion and relaxation of confined liquids
    • 10.1126/science.253.5026.1374 1:CAS:528:DyaK3MXmtFGru7g%3D 17793478 1991Sci.253.1374G
    • S Granick 1991 Motion and relaxation of confined liquids Science 253 1374 1379 10.1126/science.253.5026.1374 1:CAS:528:DyaK3MXmtFGru7g%3D 17793478 1991Sci...253.1374G
    • (1991) Science , vol.253 , pp. 1374-1379
    • Granick, S.1
  • 6
    • 0001004386 scopus 로고    scopus 로고
    • Comparison of shear flow of hexadecane in a confined geometry and in bulk
    • 10.1063/1.473692 1:CAS:528:DyaK2sXjtFCms70%3D 1997JChPh.106.7303S
    • MJ Stevens M Mondello GS Grest ST Cui HD Cochran PT Cummings 1997 Comparison of shear flow of hexadecane in a confined geometry and in bulk J. Chem. Phys. 106 7303 7314 10.1063/1.473692 1:CAS:528:DyaK2sXjtFCms70%3D 1997JChPh.106.7303S
    • (1997) J. Chem. Phys. , vol.106 , pp. 7303-7314
    • Stevens, M.J.1    Mondello, M.2    Grest, G.S.3    Cui, S.T.4    Cochran, H.D.5    Cummings, P.T.6
  • 7
    • 0000701762 scopus 로고
    • Shear flow near solids: Epitaxial order and flow boundary conditions
    • 10.1103/PhysRevA.41.6830 1:CAS:528:DyaK3cXks1Gksr4%3D 9903096 1990PhRvA.41.6830T
    • PA Thompson MO Robbins 1990 Shear flow near solids: epitaxial order and flow boundary conditions Phys. Rev. A 41 6830 6837 10.1103/PhysRevA.41.6830 1:CAS:528:DyaK3cXks1Gksr4%3D 9903096 1990PhRvA..41.6830T
    • (1990) Phys. Rev. A , vol.41 , pp. 6830-6837
    • Thompson, P.A.1    Robbins, M.O.2
  • 8
    • 0032173046 scopus 로고    scopus 로고
    • Nanorheology of liquid alkanes
    • 10.1016/S0378-3812(98)00283-0
    • SA Guptaa HD Cochran PT Cummings 1998 Nanorheology of liquid alkanes Fluid Ph. Eq. 150-151 125 131 10.1016/S0378-3812(98)00283-0
    • (1998) Fluid Ph. Eq. , vol.150-151 , pp. 125-131
    • Guptaa, S.A.1    Cochran, H.D.2    Cummings, P.T.3
  • 9
    • 0003046620 scopus 로고    scopus 로고
    • Structures, solvation forces and shear of molecular films in a rough nano-confinement
    • 10.1023/A:1018840023845 1:CAS:528:DC%2BD3MXjs1ejsrg%3D
    • J Gao WD Luedtke U Landman 2000 Structures, solvation forces and shear of molecular films in a rough nano-confinement Tribol. Lett. 9 3 13 10.1023/A:1018840023845 1:CAS:528:DC%2BD3MXjs1ejsrg%3D
    • (2000) Tribol. Lett. , vol.9 , pp. 3-13
    • Gao, J.1    Luedtke, W.D.2    Landman, U.3
  • 10
    • 18144410600 scopus 로고    scopus 로고
    • Very low friction state of a dodecane film confined between mica surfaces
    • 10.1103/PhysRevLett.94.126103 1:STN:280:DC%2BD2M3msVSktA%3D%3D 15903942 2005PhRvL.94l6103J
    • A Jabbarzadeh P Harrowell RI Tanner 2005 Very low friction state of a dodecane film confined between mica surfaces Phys. Rev. Lett. 94 126103 10.1103/PhysRevLett.94.126103 1:STN:280:DC%2BD2M3msVSktA%3D%3D 15903942 2005PhRvL..94l6103J
    • (2005) Phys. Rev. Lett. , vol.94 , pp. 126103
    • Jabbarzadeh, A.1    Harrowell, P.2    Tanner, R.I.3
  • 11
    • 0042334518 scopus 로고    scopus 로고
    • Study of a macroscopic sliding contact thermal model from microscopic models
    • DOI 10.1016/S1290-0729(01)01251-0, PII S1290072901012510
    • P Chantrenne M Raynaud 2001 Study of a macroscopic sliding contact thermal model from microscopic models Int. J. Therm. Sci. 40 7 603 621 10.1016/S1290-0729(01)01251-0 (Pubitemid 33632487)
    • (2001) International Journal of Thermal Sciences , vol.40 , Issue.7 , pp. 603-621
    • Chantrenne, P.1    Raynaud, M.2
  • 12
    • 27144553768 scopus 로고    scopus 로고
    • Simple model of microscopic rolling friction
    • DOI 10.1103/PhysRevLett.95.126104, 126104
    • OM Braun 2005 Simple model of microscopic rolling friction Phys. Rev. Lett. 95 126104 10.1103/PhysRevLett.95.126104 1:STN:280:DC%2BD2MrisFOrsw%3D%3D 16197089 2005PhRvL..95l6104B (Pubitemid 41505663)
    • (2005) Physical Review Letters , vol.95 , Issue.12 , pp. 1-4
    • Braun, O.M.1
  • 13
    • 25144495567 scopus 로고    scopus 로고
    • Molecular thermal phenomena in an ultrathin lubrication liquid film of linear molecules between solid surfaces
    • DOI 10.1080/10893950500196386
    • T Ohara D Torii 2005 Molecular thermal phenomena in an ultrathin lubrication liquid film of linear molecules between solid surfaces Microscale Ther. Phys. Eng. 9 265 279 10.1080/10893950500196386 1:CAS:528: DC%2BD2MXhtVOrtbzF (Pubitemid 41335742)
    • (2005) Microscale Thermophysical Engineering , vol.9 , Issue.3 , pp. 265-279
    • Ohara, T.1    Torii, D.2
  • 14
    • 26144459751 scopus 로고
    • Shear thickening and turbulence in simple fluids
    • DJ Evans GP Morris 1985 Shear thickening and turbulence in simple fluids Phys. Rev. Lett. 56-20 2172 2175
    • (1985) Phys. Rev. Lett. , vol.5620 , pp. 2172-2175
    • Evans, D.J.1    Morris, G.P.2
  • 15
    • 0001183646 scopus 로고
    • Shear viscosity of the hard-sphere fluid via nonequilibrium molecular dynamics
    • 10.1103/PhysRevLett.52.1333 1:CAS:528:DyaL2cXhs1ait7s%3D 1984PhRvL.52.1333E
    • JJ Erpenbeck 1984 Shear viscosity of the hard-sphere fluid via nonequilibrium molecular dynamics Phys. Rev. Lett. 52 1333 10.1103/PhysRevLett. 52.1333 1:CAS:528:DyaL2cXhs1ait7s%3D 1984PhRvL..52.1333E
    • (1984) Phys. Rev. Lett. , vol.52 , pp. 1333
    • Erpenbeck, J.J.1
  • 16
    • 0001457602 scopus 로고
    • Temperature and temperature control in nonequilibrium-molecular-dynamics simulations of the shear flow of dense liquids
    • 10.1103/PhysRevA.45.3859
    • W Loose G Ciccotti 1992 Temperature and temperature control in nonequilibrium-molecular-dynamics simulations of the shear flow of dense liquids Phys. Rev. A 45-46 3859 3866 10.1103/PhysRevA.45.3859
    • (1992) Phys. Rev. A , vol.4546 , pp. 3859-3866
    • Loose, W.1    Ciccotti, G.2
  • 17
    • 0033167304 scopus 로고    scopus 로고
    • Structural and rheological properties of n-decane confined between graphite surfaces
    • DOI 10.1016/S1385-8947(99)00063-7, PII S1385894799000637
    • R Balasundaram Sh Jianga J Belak 1999 Structural and rheological properties of n-decane confined between graphite surfaces Chem. Eng. J. 74 1-2 117 127 10.1016/S1385-8947(99)00063-7 1:CAS:528:DyaK1MXlsFemtrY%3D (Pubitemid 29435325)
    • (1999) Chemical Engineering Journal , vol.74 , Issue.1-2 , pp. 117-127
    • Balasundaram, R.1    Jiang, S.2    Belak, J.3
  • 18
    • 33646967528 scopus 로고
    • The statistical mechanical theory of transport processes IV. the equations of hydrodynamics
    • 10.1063/1.1747782 1:CAS:528:DyaG3cXlsFSmtg%3D%3D 37240 1950JChPh.18.817I
    • JH Irving JG Kirkwood 1950 The statistical mechanical theory of transport processes IV. The equations of hydrodynamics J. Chem. Phys. 18 6 817 829 10.1063/1.1747782 1:CAS:528:DyaG3cXlsFSmtg%3D%3D 37240 1950JChPh..18..817I
    • (1950) J. Chem. Phys. , vol.18 , Issue.6 , pp. 817-829
    • Irving, J.H.1    Kirkwood, J.G.2
  • 19
    • 0042100512 scopus 로고
    • Shear-induced ordering revisited
    • M. Mareschal (eds). Plenum Press New York
    • Loose, W., Hess, S.: Shear-induced ordering revisited. In: Mareschal, M. (ed.) Microscopic Simulations of Complex Flows, p. 267. Plenum Press, New York (1990)
    • (1990) Microscopic Simulations of Complex Flows , pp. 267
    • Loose, W.1    Hess, S.2
  • 20
    • 0032079048 scopus 로고    scopus 로고
    • Nanorheology of molecularly thin films of n-hexadecane in Couette shear flow by molecular dynamics simulation
    • DOI 10.1016/S0377-0257(97)00094-3
    • A Jabbarzadeh JD Atkinson RI Tanner 1998 Nanorheology of molecularly thin films of n-hexadecane in Couette shear flow by molecular dynamics simulation J. Non-Newtonian Fluid Mech. 77 1-2 53 78 0945.76006 10.1016/S0377-0257(97)00094-3 1:CAS:528:DyaK1cXis1OqsL4%3D (Pubitemid 28314548)
    • (1998) Journal of Non-Newtonian Fluid Mechanics , vol.77 , Issue.1-2 , pp. 53-78
    • Jabbarzadeh, A.1    Atkinson, J.D.2    Tanner, R.I.3
  • 21
    • 0345062279 scopus 로고    scopus 로고
    • Cause and effect reversed in non-equilibrium molecular dynamics: An easy route to transport coefficients
    • DOI 10.1016/S1089-3156(99)00006-9, PII S1089315699000069
    • F Muller-Plathe D Reith 1999 Cause and effect reversed in non-equilibrium molecular dynamics: an easy route to transport coefficients Comput. Theor. Polym. Sci. 9 203 209 10.1016/S1089-3156(99)00006-9 1:CAS:528:DyaK1MXls1yru7k%3D (Pubitemid 29453968)
    • (1999) Computational and Theoretical Polymer Science , vol.9 , Issue.3-4 , pp. 203-209
    • Muller-Plathe, F.1    Reith, D.2
  • 23
    • 0003998388 scopus 로고    scopus 로고
    • Lide D.R. (ed.) 85th edn. CRC Press
    • Lide, D.R. (ed.): Handbook of Chemistry and Physics, 85th edn. CRC Press (2004-2005)
    • (2004) Handbook of Chemistry and Physics
  • 24
    • 33744937605 scopus 로고    scopus 로고
    • Molecular dynamics characterization of thin film viscosity for EHL simulation
    • DOI 10.1007/s11249-006-9023-x
    • A Martini Y Liu RQ Snurr QJ Wang 2006 Molecular dynamics characterization of thin film viscosity for EHL simulation Tribol. Lett. 21 3 217 225 10.1007/s11249-006-9023-x (Pubitemid 43842532)
    • (2006) Tribology Letters , vol.21 , Issue.3 , pp. 217-225
    • Martini, A.1    Liu, Y.2    Snurr, R.Q.3    Wang, Q.J.4


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