【摘 要】
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Carbon monosulfide (CS), which plays an important role in a variety of research fields,has long been received considerable interest.Due to its transient nat
【机 构】
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InstituteofAtomicandMolecularPhysics,JilinUniversity,Changchun130012,China
【出 处】
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第十七届全国原子与分子物理学术会议
论文部分内容阅读
Carbon monosulfide (CS), which plays an important role in a variety of research fields,has long been received considerable interest.Due to its transient nature and large state density, the electronic states of CS have not been well understood, especially the interactions between different states.In this paper, we performed a detail ab initio study on the low-lying electronic states of CS, by means of the internally contracted multireference configuration interaction method (including Davidson correction) with scalar relativistic correction using Douglas-Kroll-Hess Hamiltonian.
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