Theoretical study on the electron transfer and phosphorescent properties of iridium(III) complexes with 2-phenylpyridyl and 8-hydroxyquinolate ligands

	Theoretical study on the electron transfer and phosphorescent properties of iridium(III) complexes with 2-phenylpyridyl and 8-hydroxyquinolate ligands
	Shi LL ; Geng Y ; Gao HZ ; Su ZM ; Wu ZJ
刊名	dalton transactions
	2010
卷号	39 期号:33 页码:7733-7740
关键词	LIGHT-EMITTING DEVICES PHOTOPHYSICAL PROPERTIES CHARGE-TRANSPORT AB-INITIO ORGANIC SEMICONDUCTORS STATE PROPERTIES EXCITED-STATE DENSITY ENERGIES ELECTROLUMINESCENCE
ISSN号	1477-9226
通讯作者	su zm
中文摘要	the complexes alq(3) and ir(ppy)(3) (q = 8-hydroxyquinolate; ppy = 2-phenylpyridyl) are typical green emitting fluorescence and phosphorescence materials, respectively. here we hybridize ir(ppy)(3) with alq(3) to investigate the optoelectronic properties of the ir(iii)-centred derivatives including (ppy)(2)irq, (ppy)irq(2) and irq(3) by using density functional methods. our calculations show that the derivative ir(iii) complexes are red emitting phosphorescence materials. the characters of the lowest triplet excited states for these ir(iii) complexes are mainly dominated by the 8-hydroxyquinolate ligand. irq(3) and (ppy)(2)irq possess good electron transfer performance, while (ppy)irq(2) might have hole transport properties.
收录类别	SCI收录期刊论文
语种	英语
WOS记录号	WOS:000280771400016
公开日期	2012-04-26
内容类型	期刊论文
源URL	[http://ir.ciac.jl.cn/handle/322003/43541]
专题	长春应用化学研究所_长春应用化学研究所知识产出_期刊论文
推荐引用方式 GB/T 7714	Shi LL,Geng Y,Gao HZ,et al. Theoretical study on the electron transfer and phosphorescent properties of iridium(III) complexes with 2-phenylpyridyl and 8-hydroxyquinolate ligands[J]. dalton transactions,2010,39(33):7733-7740.
APA	Shi LL,Geng Y,Gao HZ,Su ZM,&Wu ZJ.(2010).Theoretical study on the electron transfer and phosphorescent properties of iridium(III) complexes with 2-phenylpyridyl and 8-hydroxyquinolate ligands.dalton transactions,39(33),7733-7740.
MLA	Shi LL,et al."Theoretical study on the electron transfer and phosphorescent properties of iridium(III) complexes with 2-phenylpyridyl and 8-hydroxyquinolate ligands".dalton transactions 39.33(2010):7733-7740.