1ST PRINCIPLES INVESTIGATION OF THE VALIDITY AND RANGE OF APPLICABILITY OF THE X-RAY MAGNETIC CIRCULAR-DICHROISM SUM-RULE

被引:169
作者
WU, RQ
WANG, DS
FREEMAN, AJ
机构
[1] ACAD SINICA,INST PHYS,BEIJING 100080,PEOPLES R CHINA
[2] ARGONNE NATL LAB,DIV MED SCI,ARGONNE,IL 60439
关键词
D O I
10.1103/PhysRevLett.71.3581
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
X-ray magnetic circular dichroism (MCD) spectra and orbital angular momentum, [L(z)], for transition metal bulk and surfaces were studied for both ground state and core hole excitations using a highly precise local density approach. For Fe(001), we predict a double peak structure in both the MCD and total absorption spectra and a strong enhancement of [L(z)]. Surprisingly, the MCD orbital sum rule is found to be valid to within (5-10)%. Finally, the results suggest possible solutions to several problems faced in applying the MCD sum rule to measure [L(z)].
引用
收藏
页码:3581 / 3584
页数:4
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