TY - JOUR
T1 - A molecular dynamics study on inner pressure of microbubbles in liquid argon and water
AU - Takahashi, Hideaki
AU - Morita, Akihiro
N1 - Funding Information:
We thank Prof. Y. Kino for helpful discussion about the positronium in liquids. The present work was supported by the Grants-in-Aid by the Ministry of Education, Culture, Sports, Science and Technology (MEXT) , Japan.
PY - 2013/6/6
Y1 - 2013/6/6
N2 - This letter definitely evaluates inner pressures of microbubbles in liquid argon and water by molecular dynamics simulation. The microbubbles are modeled with spherical cavity, which circumvents most uncertainties about microscopic definition of curved surface and related quantities. In both liquids, the inner pressure deviates downward from the Young-Laplace equation when the cavity radius is smaller than two molecular diameters, and takes a maximum, about 900 and 3000 atm, respectively, at the cavity radius being ∼3 Å. The hydrogen-bonding character of water plays little specific role in the deviation of the inner pressure.
AB - This letter definitely evaluates inner pressures of microbubbles in liquid argon and water by molecular dynamics simulation. The microbubbles are modeled with spherical cavity, which circumvents most uncertainties about microscopic definition of curved surface and related quantities. In both liquids, the inner pressure deviates downward from the Young-Laplace equation when the cavity radius is smaller than two molecular diameters, and takes a maximum, about 900 and 3000 atm, respectively, at the cavity radius being ∼3 Å. The hydrogen-bonding character of water plays little specific role in the deviation of the inner pressure.
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U2 - 10.1016/j.cplett.2013.04.041
DO - 10.1016/j.cplett.2013.04.041
M3 - Article
AN - SCOPUS:84878245329
SN - 0009-2614
VL - 573
SP - 35
EP - 40
JO - Chemical Physics Letters
JF - Chemical Physics Letters
ER -