ABINITIO SCF COMPUTATIONS ON BENZENE AND BENZENIUM ION USING A LARGE CONTRACTED GAUSSIAN BASIS SET

被引:76
作者
ERMLER, WC
MULLIKEN, RS
CLEMENTI, E
机构
[1] UNIV CHICAGO,DEPT CHEM,CHICAGO,IL 60637
[2] IBM CORP,RES LAB,SAN JOSE,CA 95193
关键词
D O I
10.1021/ja00418a011
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:388 / 394
页数:7
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