LDA CALCULATION OF THE SURFACE-STATES ON THE (001), (110), AND (111) SURFACES OF ALUMINUM

被引：25

作者：

HEINRICHSMEIER, M ^{[1
]}

FLESZAR, A ^{[1
]}

EGUILUZ, AG ^{[1
]}

机构：

[1] MONTANA STATE UNIV, DEPT PHYS, BOZEMAN, MT 59717 USA

来源：

SURFACE SCIENCE | 1993年 / 285卷 / 1-2期

基金：

美国国家科学基金会;

关键词：

D O I：

10.1016/0039-6028(93)90921-6

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

We report a comprehensive set of density-functional calculations of the surface states and resonances on the low-index surfaces of Al. The calculations are based on the local-density-approximation, and utilize ab initio, norm-conserving pseudopotentials. Our results are in very good agreement with experimental data where these are available. Furthermore, a number of states that have not yet been observed either experimentally or reported theoretically are predicted.

引用

页码：129 / 141

页数：13

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