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Nonadiabatic transition in the dissociation process from inner valence states of O_2~+

机译:O_2〜+内价态在离解过程中的非绝热转变

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摘要

In a previous paper we reported a study of electronic structures of inner valence states of O_2~+ and the dissociation process from the states,where we succeeded to explain theoretically the general feature of an observed threshold photo-electron spectrum using potential energy curves obtained by second-order configuration interaction (SOCI) calculations,and gave assignments of the inner valence O_2~+ states in the 24-45 eV photon energy region.The calculated potential energy curves have also predicted qualitatively dissociation products from the states given by using threshold photoelectron-photoion coincidence (TPEPICO) spectro-scopy.
机译:在先前的论文中,我们报道了O_2〜+内价态电子结构的研究以及从这些态解离的过程,其中我们成功地使用了通过获得的势能曲线从理论上解释了观察到的阈值光电子光谱的一般特征。二阶结构相互作用(SOCI)计算,并给出了24-45 eV光子能量区域的内价O_2〜+状态的分配。所计算的势能曲线还从使用阈值光电子给出的状态定性地解离了产物光电重合(TPEPICO)光谱。

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