四川大学学报(自然科学版)
四川大學學報(自然科學版)
사천대학학보(자연과학판)
JOURNAL OF SICHUAN UNIVERSITY(NATURAL SCIENCE EDITION)
2013年
6期
1277-1284
,共8页
波函数%塌缩%部分塌缩%跃迁能%振子强度
波函數%塌縮%部分塌縮%躍遷能%振子彊度
파함수%탑축%부분탑축%약천능%진자강도
wave functions%collapse%partial collapse%transition energies%oscillator strengths
利用考虑了电子关联效应和组态相互作用的Relativistic Hartree-Fork(HFR)和LS-dependent(LS-D)的HFR自洽场方法,系统计算了Kr原子等电子系列离子的4 d电子径向波函数、轨道半径、4 p6→4 p5 n d(4≤ n≤8)辐射跃迁能和跃迁振子强度。结果显示,K r原子的等电子系列离子4 d波函数塌缩从Rb+开始,Rb+、Sr2+、Y3+离子的4 d波函数塌缩是部分塌缩;对于4d波函数塌缩的离子,4p6→4p54d辐射跃迁振子强度很强,对于4d波函数发生部分塌缩的离子,4p6→4p55d、6d、7d的跃迁也有很大增强;当4d波函数完全塌缩后,辐射跃迁主要集中在4p6→4p54d跃迁。
利用攷慮瞭電子關聯效應和組態相互作用的Relativistic Hartree-Fork(HFR)和LS-dependent(LS-D)的HFR自洽場方法,繫統計算瞭Kr原子等電子繫列離子的4 d電子徑嚮波函數、軌道半徑、4 p6→4 p5 n d(4≤ n≤8)輻射躍遷能和躍遷振子彊度。結果顯示,K r原子的等電子繫列離子4 d波函數塌縮從Rb+開始,Rb+、Sr2+、Y3+離子的4 d波函數塌縮是部分塌縮;對于4d波函數塌縮的離子,4p6→4p54d輻射躍遷振子彊度很彊,對于4d波函數髮生部分塌縮的離子,4p6→4p55d、6d、7d的躍遷也有很大增彊;噹4d波函數完全塌縮後,輻射躍遷主要集中在4p6→4p54d躍遷。
이용고필료전자관련효응화조태상호작용적Relativistic Hartree-Fork(HFR)화LS-dependent(LS-D)적HFR자흡장방법,계통계산료Kr원자등전자계렬리자적4 d전자경향파함수、궤도반경、4 p6→4 p5 n d(4≤ n≤8)복사약천능화약천진자강도。결과현시,K r원자적등전자계렬리자4 d파함수탑축종Rb+개시,Rb+、Sr2+、Y3+리자적4 d파함수탑축시부분탑축;대우4d파함수탑축적리자,4p6→4p54d복사약천진자강도흔강,대우4d파함수발생부분탑축적리자,4p6→4p55d、6d、7d적약천야유흔대증강;당4d파함수완전탑축후,복사약천주요집중재4p6→4p54d약천。
Self-consistent-field calculations of the 4 d electron radial wave function for Kr atom isoelec-tronic sequence ions have been made using relativistic Hartree-Fork (HFR) and LS-dependent HFR methods including correlation and configuration interaction .And orbital radii and the transition energies and oscillator strengths of the 4p6 →4p5 nd (4≤ n≤8) have been computed in Kr-like ions .The results show that the collapse of the 4d-wave functions start from Rb+ in Kr-like ions .The collapse of the 4d-wave functions for Rb+ 、Sr2+ 、Y3+ is partial collapse .It is found that the oscillator strengths of the 4p6→4p54d are very strong for ions in 4d-wavefunction collapse and the oscillator stregths of the 4p6 →4p5 5 d ,6 d ,7 d are also stronger for ions in 4 d-wavefunctions partial collapse .And it is found that the bulk of transition oscillator strengths is concentrated at the 4p6 →4p54d after 4d-wave function is completely collapsed .