ABINITIO CALCULATIONS ON LARGE MOLECULES USING MOLECULAR FRAGMENTS - GENERALIZATION AND CHARACTERISTICS OF FLOATING SPHERICAL GAUSSIAN BASIS SETS

被引：25

作者：

MAGGIORA, GM

CHRISTOFFERSEN, RE

机构：

[1] UNIV KANSAS,DEPT BIOCHEM,LAWRENCE,KS 66045

[2] UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045

来源：

关键词：

D O I：

10.1021/ja00442a003

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：8325 / 8332

页数：8

共 81 条

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