PRINCIPLES FOR A DIRECT SCF APPROACH TO LCAO-MO ABINITIO CALCULATIONS

被引：685

作者：

ALMLOF, J

FAEGRI, K

KORSELL, K

机构：

来源：

JOURNAL OF COMPUTATIONAL CHEMISTRY | 1982年 / 3卷 / 03期

关键词：

D O I：

10.1002/jcc.540030314

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

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页码：385 / 399

页数：15

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