Density functional study of Ag_n-lY (n = 2-10) clusters |
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作者姓名: | 刘小勇 朱正和 盛勇 |
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作者单位: | [1]College of Material Science and Engineering, Sichuan University, Chengdu 610065, China [2]Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065, China |
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基金项目: | Project supported by the National Natural Science Foundation of China (Grant No. 10676022). |
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摘 要: |
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关 键 词: | 团簇 密度泛函理论 原子掺杂 热力学稳定性 结构优化 化学稳定性 AGN 电子特性 |
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