INITIO CALCULATIONS ON LARGE MOLECULES USING MOLECULAR FRAGMENTS - SCF-MO-CI STUDIES ON LOW-LYING SINGLET AND TRIPLET-STATES OF PYRAZINE

被引:0
作者
PETKE, JD
CHRISTOFFERSEN, RE
MAGGIORA, GM
SHIPMAN, LL
机构
[1] UNIV KANSAS, DEPT CHEM, LAWRENCE, KS 66045 USA
[2] UNIV KANSAS, DEPT BIOCHEM, LAWRENCE, KS 66045 USA
[3] ARGONNE NATL LAB, DIV CHEM, ARGONNE, IL 60439 USA
关键词
D O I
暂无
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 ;
摘要
引用
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页码:343 / 355
页数:13
相关论文
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