Anisotropic charge transport in flavonoids as organic semiconductors
文献类型：期刊论文
| 作者 | Hou, Chunyuan1,2; Chen, Xin1 |
| 刊名 | molecular physics
 |
| 出版日期 | 2015-03-04 |
| 卷号 | 113期号:5页码:521-528 |
| 关键词 | organic semiconductor charge transport anisotropic flavonoid |
| 英文摘要 | a quantum mechanical approach has been used to investigate on the potential for using two naturally occurring flavonoids: quercetin and luteolin as candidates for organic semiconductor. selection of flavonoids enables to evaluate the effects of hydroxyl group structural features. the relationship between molecular packing and charge transport in flavonoids is presented. the calculated results indicate that quercetin should be an ideal candidate as high-performance p-type organic semiconductor material, while luteolin is predicted as n-type organic semiconductor material. the predicted maximum electron mobility value of quercetin is 0.075cm(2) v-1 s(-1), which appears at the orientation angle near 91 degrees/271 degrees of conducting channel on the reference planes b-c. theoretical investigation of natural semiconductors is helpful for designing higher performance electronic materials used in biochemical and industrial field to replace expensive and rare organic materials. |
| WOS标题词 | science & technology ; physical sciences |
| 类目[WOS] | physics, atomic, molecular & chemical |
| 研究领域[WOS] | physics |
| 关键词[WOS] | field-effect mobility ; electron-transfer ; heterocyclic oligomers ; hopping transport ; single-crystals ; hole mobilities ; solar-cells ; pentacene ; energy ; polarization |
| 收录类别 | SCI |
| 语种 | 英语 |
| WOS记录号 | WOS:000349441400011 |
| 公开日期 | 2016-05-09 |
| 源URL | [http://cas-ir.dicp.ac.cn/handle/321008/145993]  |
| 专题 | 大连化学物理研究所_中国科学院大连化学物理研究所 |
| 作者单位 | 1.Anhui Polytech Univ, Dept Biochem Engn, Wuhu, Peoples R China 2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian, Peoples R China |
| 推荐引用方式 GB/T 7714 | Hou, Chunyuan,Chen, Xin. Anisotropic charge transport in flavonoids as organic semiconductors[J]. molecular physics,2015,113(5):521-528. |
| APA | Hou, Chunyuan,&Chen, Xin.(2015).Anisotropic charge transport in flavonoids as organic semiconductors.molecular physics,113(5),521-528. |
| MLA | Hou, Chunyuan,et al."Anisotropic charge transport in flavonoids as organic semiconductors".molecular physics 113.5(2015):521-528. |
入库方式： OAI收割
来源：大连化学物理研究所
浏览0
下载0
收藏0
其他版本
除非特别说明，本系统中所有内容都受版权保护，并保留所有权利。