A ZINDO/1-CI Study of Substituted Triphenylamines for Use as Charge Transfer Materials  

作　　者：QiangLI XiaoXiangZHANG YiMENG MinBoCHEN 

机构地区：[1]ShanghaiInstituteofOrganicChemistry,ChineseAcademyofSciences,Shanghai200032 [2]ShanghaiInstituteofOrganicChemistry,ChineseAcademyofSciences,Shanghai200032／／ChemistryDepartment,EastChinaUniversityofScienceandTechnology,Shanghai200237

出　　处：《Chinese Chemical Letters》2005年第5期693-696,共4页中国化学快报（英文版）

基　　金：The authors gratefully acknowledge financial support from the National High Technology Research and Development Program.863 Proect.(No.2001A31307).

摘　　要：Electronic spectra of substituted triphenylamines are investigated in this paper by time dependent perturbation theory and ZINDO/1-CI calculation.

关 键 词：ELECTROLUMINESCENCE triphenylamine ZINDO organic LED. 

分 类 号：O625.632[理学—有机化学] TN104.3[理学—化学]