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中国物理学会期刊

Ag(110)表面声子谱的分析型EAM模型计算

CSTR: 32037.14.aps.53.1946

Surface phonons on Ag (110): A study by means of analytic embedded-atom method

CSTR: 32037.14.aps.53.1946
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  • 应用晶格动力学,结合分析型EAM模型,计算了Ag(110)表面声子频率和振动极化方向,通过比较弛豫与未弛豫表面的计算结果,发现弛豫后的结果与He原子散射实验数据符合得很好,表面振动的极化局域特征符合表面的二维对称性,沿方向的S2和S3表面模也和实验结果—致.

     

    The surface phonons on Ag(110)are studied in the present paper by means of the lattice dynamics and an analytic embeddedatom method(EAM). The phonon frequencies and disperse curves with surface relaxation are in good agreement with the data obtained by the helium atom scattering experiments. The polarization and localization of surface vibration are in accord with the two-dimensional symmetry in the surface. The S2 and S3 surface modes along-direction are predicted, which are in agreement with the helium atom scattering experiments.

     

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