A theoretical approach for simulations of anisotropic charge carrier mobility in organic single crystal semiconductors
文献类型：期刊论文
| 作者 | Liu, Yuan3; Chu, Tianshu1,2 |
| 刊名 | ORGANIC ELECTRONICS
 |
| 出版日期 | 2018-02-01 |
| 卷号 | 53页码:165-184 |
| 关键词 | Organic Single Crystal Semiconductors Charge Carrier Mobility Angular Resolution Anisotropic Mobility Effective One-dimensional Diffusion Equation Model N-type And P-type Organic Electronic Materials |
| ISSN号 | 1566-1199 |
| DOI | 10.1016/j.orgel.2017.11.034 |
| 文献子类 | Review |
| 英文摘要 | Charge carrier mobility is important for organic semiconductor materials and mainly determines their device performance. Thereby how to improve carrier mobility lies at the heart of the development of organic electronics. Theoretical predictions and simulations can provide guidelines towards the possible realization of high mobility and the design of highly functional semiconductor materials and thus can help to achieve further discoveries in the field. In this paper, we review a recently proposed theoretical method (an effective one-dimensional diffusion equation model) which presents the first analytical expression for angular resolution anisotropic mobility of organic single crystal semiconductors. The method encompasses the hopping mechanism, Marcus-Hush theory and first-principles calculations and is suitable to characterizing the anisotropic transport behaviors in organic single crystal semiconductors as well as to studying the property-structure relationship in semiconductor materials. Illustration of applications of the method demonstrated its capabilities in description and understanding of the transport of charges, correct prediction of angular resolution anisotropic mobility, and assist in the design of n-type and p-type organic electronic materials. |
| WOS关键词 | FIELD-EFFECT TRANSISTORS ; DENSITY-FUNCTIONAL THEORY ; POLYTHIOPHENE THIN-FILM ; TRANSPORT PROPERTIES ; ELECTRON-TRANSFER ; HOLE MOBILITY ; DIBENZO-TETRATHIAFULVALENE ; PERFORMANCE ; PENTACENE ; RUBRENE |
| WOS研究方向 | Materials Science ; Physics |
| 语种 | 英语 |
| WOS记录号 | WOS:000418793500022 |
| 出版者 | ELSEVIER SCIENCE BV |
| 源URL | [http://cas-ir.dicp.ac.cn/handle/321008/169206]  |
| 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 |
| 通讯作者 | Chu, Tianshu |
| 作者单位 | 1.Qingdao Univ, Coll Phys, Inst Computat Sci & Engn, Lab New Fiber Mat & Modern Text,Growing Base Stat, Qingdao 266071, Peoples R China 2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116023, Peoples R China 3.Univ Alberta, Dept Phys, Edmonton, AB T6G 2R3, Canada |
| 推荐引用方式 GB/T 7714 | Liu, Yuan,Chu, Tianshu. A theoretical approach for simulations of anisotropic charge carrier mobility in organic single crystal semiconductors[J]. ORGANIC ELECTRONICS,2018,53:165-184. |
| APA | Liu, Yuan,&Chu, Tianshu.(2018).A theoretical approach for simulations of anisotropic charge carrier mobility in organic single crystal semiconductors.ORGANIC ELECTRONICS,53,165-184. |
| MLA | Liu, Yuan,et al."A theoretical approach for simulations of anisotropic charge carrier mobility in organic single crystal semiconductors".ORGANIC ELECTRONICS 53(2018):165-184. |
入库方式： OAI收割
来源：大连化学物理研究所
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