APPLICATION OF MOLECULAR-MODELS TO ELECTRONIC-STRUCTURE CALCULATIONS OF DEFECTS IN OXIDE CRYSTALS .1. PARAMETRIZATION OF THE MODIFIED INDO METHOD

被引:95
作者
SHLUGER, A
机构
来源
THEORETICA CHIMICA ACTA | 1985年 / 66卷 / 06期
关键词
D O I
10.1007/BF00547876
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 ;
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页码:355 / 363
页数:9
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