Low-frequency oscillations in nanoclusters of lanthanum trifluoride

Low-frequency oscillations in nanoclusters of lanthanum trifluoride
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三氟化镧纳米团簇的低频振荡

DOI:
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发表时间:
1998
期刊:
影响因子:
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通讯作者:
A. Harker
A. Harker
中科院分区:
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文献类型:
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作者:
V. Bulatov;R. Grimes;A. Harker

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We report classical molecular dynamics simulations of clusters of up to 3120 atoms of lanthanum trifluoride. The results are analysed to show the extent to which such small clusters can also be described by simple continuum methods. The oscillations in the shape of the solid nanoclusters agree very well in frequency and magnitude with those deduced from classical elasticity theory. The liquid-drop oscillations which are seen in the molecular dynamics simulations show that the simulations reproduce the surface tension behaviour of ionic systems.