Monte Carlo Simulations for Two-Dimensional Hydrogen Bonding Model of Acetic Acid

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  • 酢酸の二次元水素結合モデルのモンテカルロ法計算
  • サクサン ノ 2ジゲン スイソ ケツゴウ モデル ノ モンテカルロホウ ケイサン

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Acetic acid molecules form chain-like structure in liquid phase, and cyclic dimer in vapor phase by effects of hydrogen bond. This structure change can be deduced that occuring in phase transition or evaporation / condensation process. Then, we made out a new two-dimensional model that reproduces properties of hydrogen bond. In this study, we carried out Monte Carlo Simulations to search temperature / density dependences of phase transition on this model.

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