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
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
收藏
页码:8325 / 8332
页数:8
相关论文
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