SELF-CONSISTENT ELECTRONIC-STRUCTURE FOR A MO(001) SURFACE WITH SATURATED H-ADSORPTION

被引:15
作者
KERKER, GP
YIN, MT
COHEN, ML
机构
[1] UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
[2] UNIV CALIF BERKELEY,DEPT PHYS,BERKELEY,CA 94720
关键词
D O I
10.1016/0038-1098(79)91090-1
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
The band structure for a Mo (001) surface covered with a saturated monolayer of hydrogen is calculated self-consistently using the pseudopotential method in a mixed-basis representation. Two adsorbate bands are found below the bottom of the molybdenum bulk bands. Most of the intrinsic surface states of the clean (001) surface also exist on the hydrogen covered surface at lower energies. The results are used to identify H induced structures observed in recent photoemission studies of hydrogen on W (001). © 1979.
引用
收藏
页码:433 / 436
页数:4
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