CALCULATION OF MAGNETIC-X-RAY DICHROISM (MXD) SPECTRA USING THE SPIN-POLARIZED RELATIVISTIC LINEAR-MUFFIN-TIN-ORBITAL METHOD OF BAND-STRUCTURE CALCULATION

被引:10
作者
EBERT, H [1 ]
GUO, GY [1 ]
机构
[1] SERC,DARESBURY LAB,WARRINGTON WA4 4AD,CHESHIRE,ENGLAND
关键词
D O I
10.1016/0038-1098(94)90258-5
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
The description of the electronic structure of magnetic transition meta systems by using the spin polarized relativistic linear-muffin-tin-orbital (SPRLMTO) method of band structure calculation leads to a very efficient and reliable way to calculate their magnetic X-ray dichroism (MXD) spectra. This is demonstrated by comparing results for the L2,3-spectra of pure Fe with spectra obtained using the numerically more accurate but computationally more demanding spin polarized relativistic Korringa-Kohn-Rostoker (SPRKKR) method.
引用
收藏
页码:85 / 87
页数:3
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