UNOCCUPIED ENERGY-BANDS, EXCHANGE SPLITTING, AND SELF-ENERGY OF IRON

被引:107
作者
SANTONI, A [1 ]
HIMPSEL, FJ [1 ]
机构
[1] IBM CORP,THOMAS J WATSON RES CTR,DIV RES,YORKTOWN HTS,NY 10598
来源
PHYSICAL REVIEW B | 1991年 / 43卷 / 02期
关键词
D O I
10.1103/PhysRevB.43.1305
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Unoccupied energy bands of iron are mapped by inverse photoemission from Fe(100), Fe(110), and Fe(111). The ferromagnetic exchange splitting delta-E(ex) of the uppermost d band is measured for the H'25 point, where the minority- and majority-spin subbands are both empty (delta-E(ex) = 1.8 eV with H'25 down at 1.9 eV and H'25 up at 0.12 eV above E(F)). Several other critical points are determined, such as the minority-spin GAMMA-12 and P3 points, the majority-spin N3 point, and the higher-lying H15,H1 points of s,p character. Critical points and exchange splitting are compared with first-principles, local-density calculations. The real part of the self-energy is obtained from this comparison, and the imaginary part by measuring the lifetime broadening. In the d-band region, the self-energy causes a 10% compression of the bands and a linear broadening GAMMA(E) almost-equal-to 0.6\E - E(F)\.
引用
收藏
页码:1305 / 1312
页数:8
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