MOLECULAR SCALE MECHANISM ON EVAPORATION AND REMOVAL PROCESS OF ADHERENT MOLECULES ON SURFACE BY BURNT GAS

  • Yang, Y.J. (Department of Automotive Engineering, Jinju National University) ;
  • Lee, C.W. (Department of Automotive Engineering, Jinju National University) ;
  • Kadosaka, O. (Chugai Ro Co., Ltd.) ;
  • Shibahara, M. (Department of Mechanical Engineering, Osaka University) ;
  • Katsuki, M. (Department of Mechanical Engineering, Osaka University) ;
  • Kim, S.P. (Department of Mechanical Engineering, Dong-A University)
  • Published : 2006.04.01

Abstract

The interaction between adherent molecules and gas molecules was modeled in the molecular scale and simulated by the molecular dynamics method in order to understand evaporation and removal processes of adherent molecules on metallic surface using high temperature gas flow. Methanol molecules were chosen as adherent molecules to investigate effects of adhesion quantity and gas molecular collisions because the industrial oil has too complex structures of fatty acid. Effects of adherent quantity, gas temperature, surface temperature and adhesion strength for the evaporation rate of adherent molecules and the molecular removal mechanism were investigated and discussed in the present study. Evaporation and removal rates of adherent molecules from metallic surface calculated by the molecular dynamics method showed the similar dependence on the surface temperature shown in the experimental results.

Keywords

References

  1. Kim, S. K., Im, K. H., Hwang, C. S. and Yang, I. Y. (2002). A study on experimental characteristics of energy absorption control in thin-walled tube for the use of vehicular-structure members. Int. J. Automotive Technology 3, 4, 137-145
  2. Kotake, S. and Wakuri, S. (1994). Molecular dynamics study of heat conduction in solid materials. JSME Int. J. B, 37, 1, 103-108 https://doi.org/10.1299/jsmeb.37.103
  3. Lee, K. W. and Kim, K. S. (2001). Influence of initial combustion in SI engine on following combustion stage and cycle-by-cycle variations in combustion process. Int. J. Automotive Technology 2, 3, 85-91
  4. Maruyama, S. and Kimura, T. (1999). A study on thermal resistance over a solid-liquid interface by the molecular dynamics method. Thermal Science & Engineering 7, 1, 63-68
  5. Ohara, T. (1999). Intermolecular energy transfer characteristics of simple liquid in heat conduction. Thermal Science & Engineering 7, 1, 53-61
  6. Ohara, T. and Odagiri, H. (1998). Molecular dynamics study on intermolecular energy transfer in water. Thermal Science & Engineering 6, 4, 1-8
  7. Reid, R.C., Prausnitz, J. M. and Sherwood T. K. (1977). The Propertied of Gases and Liquids. 3rd Edn.. McGraw-Hill. New York
  8. Shibahara, M., Takada, Y., and Katsuki, M. (1999). Molecular dynamics study on evaporation process of adhered thin film on surface (Effects of thickness of thin film and surface potential energy). Thermal Science & Engineering 7, 5, 41-50
  9. Shudo, T., Nagano, T. and Kobayashi, M. (2003). Combustion characteristics of waste-pyrolysis gases in an internal combustion engine. Int. J. Automotive Technology 4, 1, 1-8
  10. Ueda, A. (1990). Computer Simulation. Asakurasyoten. Tokyo, Japan
  11. Watanabe, A. and Kotake, S. (1993). Study on molecular dynamics mechanism of heat conduction. Trans. JSME, B, 59, 3913-3918 https://doi.org/10.1299/kikaib.59.3913
  12. William, L. J., Madura, J. D., and Swenson C. J. (1984). Optimized intermolecular potential functions for liquid hydrocarbons. J. Am. Chem. Soc., 106, 6638-6646 https://doi.org/10.1021/ja00334a030
  13. William, L. J. (1986). Optimized intermlecular potential functions for liquid alcohol. J. Phys. Chem., 90, 1276-1284 https://doi.org/10.1021/j100398a015