摘要
本文根据文献〔1〕提出的电子瞬时配对形成未饱和共价键的物理模型,利用ACQM〔2〕方法对H_(9)体心立方结构和能量进行了计算和研究。获得了这种构型的势能曲线,结果表明在r=1.55a_(0)处有一极小能量—5.10a.u.。
The potential energy curve for the body-centred Cubic structure of H9 system is calculated by the ACQM method. The result of the calculation shows that the curve has a minimal energy -5.10 a. u. at r = 1.55a0. This means that the body-centred cubic structure is a more stable structure of H9.
出处
《原子与分子物理学报》
CAS
CSCD
北大核心
1989年第3期1053-1058,共6页
Journal of Atomic and Molecular Physics
