额外的垄断电子排放对有限离子电荷谱的影响,当黄金原子中的电子空缺级崩溃时。

А.П. Чайников, А. Г. Кочур, А.И. Дуденко, В. А. Явна
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摘要

计算了金原子K、L、M、N和O层空位级联衰变产生最终离子的概率。通过直接构建和分析衰变树来模拟空位的级联衰变,并使用在Pauli-Fock近似中计算的分支比和跃迁能量来模拟在级联衰变过程中产生的多空位电子构型。考虑到伴随级联跃迁的额外单极子电子抛射(振荡)导致最终离子的平均电荷略有增加,增加了0.15-0.23e。在4p3/2、4d3/2和4d5/2亚层空位的级联衰变中,最终离子的计算平均电荷的相对增加最大(3.6-3.9%),4f空位的衰减最小(0.8%)。尽管平均离子电荷的变化微不足道,但当考虑到额外的电子喷射时,在某些情况下,电荷谱的结构发生了足够明显的变化。期望在模拟以重原子为辐射敏化剂的级联能量再发射过程时,考虑振荡过程的影响不显著。
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Влияние дополнительных монопольных выбросов электронов на зарядовые спектры конечных ионов при каскадном распаде электронных вакансий в атоме золота
The probabilities of the formation of final ions produced by the cascade decays of vacancies in the K, L, M, N, and O shells of the gold atom are calculated. Simulation of the cascade decays of vacancies is performed by direct construction and analysis of decay trees using branching ratios and transition energies calculated in the Pauli–Fock approximation for multivacancy electron configurations arising in the course of the cascade decay. Accounting for additional monopole ejections of electrons (shake-off) accompanying the cascade transitions leads to a slight increase in the average charges of the final ions, by 0.15–0.23e. The largest relative increase in the calculated average charges of the final ions (by 3.6–3.9%) is observed upon the cascade decay of vacancies in 4p3/2, 4d3/2, and 4d5/2 subshells, and the smallest (by 0.8%) occurs in the decay of 4f-vacancy. Despite insignificant changes in the average ion charges, the structure of the charge spectra in some cases changes noticeably enough when additional electron ejections are taken into account. It is expected that in simulation of the cascade energy reemission processes when heavy atoms are used as radiosensitizers, the effect of accounting for shake-off processes will be insignificant.
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