PHOTOPHYSICS AND POTENTIAL-ENERGY HYPERSURFACES OF PERMETHYLATED OLIGOSILANES

被引:72
作者
PLITT, HS
DOWNING, JW
RAYMOND, MK
BALAJI, V
MICHL, J
机构
来源
JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS | 1994年 / 90卷 / 12期
关键词
D O I
10.1039/ft9949001653
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
Information on the potential-energy surfaces of the ground and 1sigmasigma* excited states of oligosilane chains, collected from experimental and theoretical sources, is discussed in terms of electronic structure and the mechanisms of bond and excitation delocalization.
引用
收藏
页码:1653 / 1662
页数:10
相关论文
共 44 条
[41]  
WELSH WJ, 1986, MACROMOLECULES, V19, P2987
[42]   GAUSSIAN-BASIS SETS FOR USE IN CORRELATED MOLECULAR CALCULATIONS .3. THE ATOMS ALUMINUM THROUGH ARGON [J].
WOON, DE ;
DUNNING, TH .
JOURNAL OF CHEMICAL PHYSICS, 1993, 98 (02) :1358-1371
[43]  
ZERNER M, 1973, THEOR CHIM ACTA, V32, P111
[44]  
[No title captured]