XU Ai-jin, ZHOU Zhe-wei, HU Guo-hui. Molecular Dynamics of Dewetting of Ultra-Thin Water Films on a Solid Substrate[J]. Applied Mathematics and Mechanics, 2007, 28(12): 1387-1391.
Citation: XU Ai-jin, ZHOU Zhe-wei, HU Guo-hui. Molecular Dynamics of Dewetting of Ultra-Thin Water Films on a Solid Substrate[J]. Applied Mathematics and Mechanics, 2007, 28(12): 1387-1391.

Molecular Dynamics of Dewetting of Ultra-Thin Water Films on a Solid Substrate

  • Received Date: 2007-10-22
  • Rev Recd Date: 2007-10-29
  • Publish Date: 2007-12-15
  • Molecular dynamics simulation was applied to study the instability and rupture process of ultra thin water films on a solid substrate. Results show the small disturbance of the film will develop linearly due to the spinodal instability, whereas the interactions between solid and liquid have less in fluences on the initial growth. Then the rupture occurs and the rim recedes with a dynamic contact angle. The radius of the rim varies with time as the square root of the time, which is consistent with the macroscopic theory available. Stronger interaction between solid and liquid will postpone rupture time, decline the dynamic contact angle and raise the density of water near the interface between solid and liquid.
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  • [1]
    Oron A, Davis S H,Bankoff S G.Long-scale evolution of thin liquid films[J].Review Modern Physics,1997,69(3):931-980. doi: 10.1103/RevModPhys.69.931
    [2]
    Werder T,Walther J H,Jaffe R L,et al.On the water-carbon interaction for use in molecular dynamics simulations of graphite and carbon nanotubes[J].J Physical Chemistry B,2003,107(6):1345-1352. doi: 10.1021/jp0268112
    [3]
    GUO Hong-kai,FANG Hai-ping.Drop size dependence of the contact angle of nanodroplets[J].Chinese Physical Letters,2005,22(4):787-790. doi: 10.1088/0256-307X/22/4/002
    [4]
    Koishi T,Yoo S, Yasuoka K,et al.Nanoscale hydrophobic interaction and nanobubble nucleation[J].Physical Review Letters,2004,93(18):185701. doi: 10.1103/PhysRevLett.93.185701
    [5]
    Li J Y,Gong X J,Lu H J,et al.Electrostatic gating of a nanometer water channel[J].Proceeding of the National Academy of Science of United States of America,2007,104(10):3687-3692. doi: 10.1073/pnas.0604541104
    [6]
    Poulikakos D,Arcidiacono S,Maruyama S. Molecular dynamics simulation in nanoscale heat transfer:A Review[J].Microscale Thermophysical Engineering,2003,7(3):181-206. doi: 10.1080/10893950390219047
    [7]
    TIEN Chang-lin,WENG Jian-gan.Molecular dynamics simulation of nanoscale interfacial phenomena in fluids[J].Advances in Applied Mechanics,2001,38:95-146.
    [8]
    Hwang C C,Hsieh J Y,Chang K H,et al.A study of rupture process of thin films by a molecular dynamics simulation[J].Physica A,1998,256(3):333-341. doi: 10.1016/S0378-4371(98)00113-7
    [9]
    Liu H, Bhattacharya A,Chakrabarti A.Early stages of dewetting of microscopically thin polymer films:A molecular dynamics study[J].J Chemical Physics,1998,109(19):8607-8611. doi: 10.1063/1.477526
    [10]
    Koplik J,Banavar J R.Molecular simulation of dewetting[J].Physics Review Letters,2000,84(19):4401-4404. doi: 10.1103/PhysRevLett.84.4401
    [11]
    Bertrand E,Blake T D,Ledauphin V,et al.Dynamics of dewetting at the nanoscale using molecular dynamics[J].Langmuir,2007,23(7):3774-3785. doi: 10.1021/la062920m
    [12]
    Reiter G.Dewetting of thin polymer films[J].Physical Review Letters,1992,68(1):75-78. doi: 10.1103/PhysRevLett.68.75
    [13]
    Herminghaus S,Jacobs K,Mecke K,et al.Spinodal dewetting in liquid crystal and liquid metal films[J].Science,1998,282(5390):916-919. doi: 10.1126/science.282.5390.916
    [14]
    De Gennes P G,Brochard-Wyart F B,Quéré D.Capillarity and Wetting Phenomena[M].New York: Springer Verlag Inc,2004.
    [15]
    van der Spoel D,Lindahl E,Hess B,et al.GROMACS: fast, flexible, and free[J].J Computational Chemistry,2005,26(16):1701-1718. doi: 10.1002/jcc.20291
    [16]
    Redon C, Brochard-Wyart F B, Rondelez F.Dynamics of dewetting[J].Physical Review Letters,1991,66(6):715-718. doi: 10.1103/PhysRevLett.66.715
    [17]
    van Giessen A E,Bukman D J,Widom B.Contact angles of liquid drops on low-energy solid surfaces[J].J Colloid and Interface Science,1997,192(1):257-265. doi: 10.1006/jcis.1997.5027
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