熱工学講演会講演論文集
Online ISSN : 2433-1317
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C235 分子動力学による NaCl の核生成
古石 貴裕泰岡 顕治戎崎 俊一
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p. 401-402

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Nucleation process of NaCl is reproduced by using molecular dynamics (MD) simulation. We carried out MD simulations in the 13824 ions system under the free boundary condition. Critical nucleus size and nucleation rate are directly estimated from simulation results without nucleation theory. We also carried out for the 13824 and 125000 ions systems under the periodic boundary condition to compare with the results of free boundary condition. All simulations are calculated by using the special purpose computer, "MDGRAPE-2", for molecular dynamics simulation.
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© 2002 一般社団法人日本機械学会
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