COMMUNICATIONS Vibrational energy relaxation of adsorbate vibrations: A theoretical study of the H/Si(111) system

COMMUNICATIONS Vibrational energy relaxation of adsorbate vibrations: A theoretical study of the H/Si(111) system
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通讯 吸附质振动的振动能量弛豫:H/Si(111) 系统的理论研究

DOI:
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发表时间:
1996
期刊:
影响因子:
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通讯作者:
D. Bougeard
D. Bougeard
中科院分区:
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文献类型:
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作者:
V. A. Ermoshin;A. Kazansky;K. Smirnov;D. Bougeard

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本文用量子力学方法处理氢原子的运动,用分子动力学方法计算了吸附在Si(111)表面上的氢原子第一激发伸缩振动的能量弛豫率。弛豫是通过三个弯曲模的激发和188 cm−1声子的发射而发生的。
The energy relaxation rate for the first excited stretching vibration of hydrogen atoms adsorbed on an Si(111) surface is calculated treating the motions of the H atoms quantum mechanically and computing the substrate phonon spectrum by molecular dynamics. The relaxation occurs through excitation of three bending modes and emission of a 188 cm−1 phonon.