Electronic Properties of Mixed-Stack Organic Charge-Transfer Crystals
文献类型：期刊论文
| 作者 | Zhu, Lingyun1,2,3; Yi, Yuanping1,2,4; Fonari, Alexandr1,2; Corbin, Nathan S.1,2; Coropceanu, Veaceslav1,2; Bredas, Jean-Luc1,2 |
| 刊名 | JOURNAL OF PHYSICAL CHEMISTRY C
 |
| 出版日期 | 2014-07-03 |
| 卷号 | 118期号:26页码:14150-14156 |
| ISSN号 | 1932-7447 |
| DOI | 10.1021/jp502411u |
| 英文摘要 | The electronic structures of a series of donor acceptor mixed-stack crystals have been investigated by means of density functional theory calculations. The results highlight that a number of the donor acceptor crystals under consideration are characterized by wide valence and conduction bands, large hole and electron electronic couplings, and as a result very low hole and electron effective masses. The fact that the effective masses and electronic couplings for holes and electrons are nearly equal along the stacking directions implies that the hole and electron mobilities in these systems are also similar. In addition, in several of these crystals, charge transport has a two-dimensional character. The impact on the charge transport properties of the electronic couplings between donor and acceptor frontier orbitals and of the related energy gaps is also discussed. |
| 语种 | 英语 |
| WOS记录号 | WOS:000338693600010 |
| 出版者 | AMER CHEMICAL SOC |
| 源URL | [http://ir.iccas.ac.cn/handle/121111/53185]  |
| 专题 | 中国科学院化学研究所 |
| 通讯作者 | Coropceanu, Veaceslav |
| 作者单位 | 1.Georgia Inst Technol, Sch Chem & Biochem, Atlanta, GA 30332 USA 2.Georgia Inst Technol, Ctr Organ Photon & Elect, Atlanta, GA 30332 USA 3.Natl Ctr Nanosci & Technol, Beijing 100190, Peoples R China 4.Chinese Acad Sci, Inst Chem, Beijing 100190, Peoples R China |
| 推荐引用方式 GB/T 7714 | Zhu, Lingyun,Yi, Yuanping,Fonari, Alexandr,et al. Electronic Properties of Mixed-Stack Organic Charge-Transfer Crystals[J]. JOURNAL OF PHYSICAL CHEMISTRY C,2014,118(26):14150-14156. |
| APA | Zhu, Lingyun,Yi, Yuanping,Fonari, Alexandr,Corbin, Nathan S.,Coropceanu, Veaceslav,&Bredas, Jean-Luc.(2014).Electronic Properties of Mixed-Stack Organic Charge-Transfer Crystals.JOURNAL OF PHYSICAL CHEMISTRY C,118(26),14150-14156. |
| MLA | Zhu, Lingyun,et al."Electronic Properties of Mixed-Stack Organic Charge-Transfer Crystals".JOURNAL OF PHYSICAL CHEMISTRY C 118.26(2014):14150-14156. |
入库方式： OAI收割
来源：化学研究所
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