【摘 要】
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The entire 12 Λ-S electronic states of GeC1+ cation are calculated with high-level ab initio electronic structure internally contracted multi-reference configuration interaction plus Davidson correcti
【机 构】
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河南师范大学物理与电子工程学院,河南新乡,453007
【出 处】
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第十八届全国原子与分子物理学术会议
论文部分内容阅读
The entire 12 Λ-S electronic states of GeC1+ cation are calculated with high-level ab initio electronic structure internally contracted multi-reference configuration interaction plus Davidson correction (MRCI+Q) method at the level of the all-electron aug-cc-pVQZ,where the Douglas-Kroll scalar relativistic effect is taken into account.
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