CORRELATION EFFECTS ON BARRIERS TO PROTON-TRANSFER IN INTRAMOLECULAR HYDROGEN-BONDS - ENOL TAUTOMER OF MALONDIALDEHYDE STUDIED BY AB-INITIO SCF-CI CALCULATIONS

被引:65
作者
KARLSTROM, G
JONSSON, B
ROOS, B
WENNERSTROM, H
机构
[1] CHEM CTR,INST PHYS CHEM,S-22007 LUND,SWEDEN
[2] UNIV BERGEN,INST THEORET CHEM,N-5014 BERGEN,NORWAY
[3] UNIV STOCKHOLM,INST THEORET PHYS,S-11346 STOCKHOLM,SWEDEN
关键词
D O I
10.1021/ja00438a015
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:6851 / 6854
页数:4
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