Molecular simulation

Bibliographic Information

Other Title
  • 分子シミュレーション
  • 分子シミュレーションの基礎と応用 分子シミュレーション--現状と将来
  • ブンシ シミュレーション ノ キソ ト オウヨウ ブンシ シミュレーション ゲンジョウ ト ショウライ
  • −Present and future−
  • −現状と将来−

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Abstract

<p>We describe the current roles and applications of the classical molecular dynamics method (MD). The analyses of experimental data, showing the atomistic behavior of macrophenomena were carried out by means of MD. The application to mesoscale and macrophenomena is also discussed. Finally, the importance of improving interatomic potential models is stated.</p>

Journal

  • Oyo Buturi

    Oyo Buturi 76 (3), 297-304, 2007-03-10

    The Japan Society of Applied Physics

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