Computational Survey of New Ice Polymorphs

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Other Title
  • 新しい氷の結晶構造を計算機で探す
  • 最近の研究から 新しい氷の結晶構造を計算機で探す
  • サイキン ノ ケンキュウ カラ アタラシイコオリ ノ ケッショウ コウゾウ オ ケイサンキ デ サガス

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Abstract

<p>Predicting stable crystal structures only from information on the molecular shape and intermolecular interactions is a very difficult problem of modern physics. We have used computers to study the crystal structures of water under various thermodynamic conditions and found several new ice structures. This is an interesting area of research involving a variety of unsolved problems.</p>

Journal

  • Butsuri

    Butsuri 75 (7), 410-415, 2020-07-05

    The Physical Society of Japan

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