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【摘 要】
：
用分子图形软件设计出多种锗原子团簇Ge7的模型,并进行B3LYP密度泛函几何构型优化和振动频率计算,得到8种稳定的同分异构体结构。在锗原子团簇中,大部分原子以三、四、五配位
【机 构】
：
固体表面物理化学国家重点实验室厦门大学化学系,固体表面物理化学国家重点实验室厦门大学化学系,固体表面物理化学国家重点实验室厦门大学化学系,固体表面物理化学国家重点实验室厦门大学化学系,固体表面物理化学
【出 处】
：
结构化学
【发表日期】
：
2002年04期
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