CHEMISORPTION OF MOLECULAR-OXYGEN ON COPPER CLUSTERS STUDIED BY JELLIUM AND MO-LCAO MODELS

被引：4

作者：

GRONBECK, H ^{[1
]}

ANDERSSON, M ^{[1
]}

ROSEN, A ^{[1
]}

机构：

[1] CHALMERS UNIV TECHNOL, S-41296 GOTHENBURG, SWEDEN

来源：

NANOSTRUCTURED MATERIALS | 1995年 / 5卷 / 02期

关键词：

D O I：

10.1016/0965-9773(95)00015-1

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

Chemisorption of molecular oxygen on copper clusters is investigated within the local spin density approximation, using a self-consistent jellium approach and MO-LCAO calculations. The presented results show that the simple jellium model describes the chemisorption process in a satisfactory manner and is able to explain the main trends in the measured chemisorption properties of O-2 on copper clusters.

引用

页码：193 / 206

页数：14

共 36 条

[1]

ANDERSSON M, 1993, NANOSTRUCT MATER, V3, P337, DOI 10.1016/0965-9773(93)90096-T

[2]

[Anonymous], [No title captured]

[3] EXTENDED X-RAY-ABSORPTION FINE-STRUCTURE OF SMALL CU AND NI CLUSTERS - BINDING-ENERGY AND BOND-LENGTH CHANGES WITH CLUSTER SIZE [J].