Theoretical designs of molecular photonics materials
文献类型：期刊论文
| 作者 | Yi, Yuanping; Zhu, Lingyun; Shuai, Zhigang |
| 刊名 | MACROMOLECULAR THEORY AND SIMULATIONS
 |
| 出版日期 | 2008-01-24 |
| 卷号 | 17期号:1页码:12-22 |
| 关键词 | Computer Modeling Conjugated Polymers Multiphoton Absorption Simulations Structure-property Relations |
| ISSN号 | 1022-1344 |
| DOI | 10.1002/mats.200700054 |
| 英文摘要 | Different theoretical models for the computation of multiphoton absorption response are described and reviewed. The influences of intrinsic molecular structure parameters on the multiphoton absorption properties for organic conjugated molecules are discussed in terms of: i) the donor/acceptor substitutions; ii) the pi conjugation length; iii) the ground-state polarization mimicking structural character such as bond-length alternation; iv) the molecular dimensionality; and, v) some other possible factors, such as vibronic coupling and the solvent, as well as aggregation effects. Some theoretical designing strategies for organic materials with large multiphoton cross-sections are then proposed. |
| 语种 | 英语 |
| WOS记录号 | WOS:000252870200002 |
| 出版者 | WILEY-V C H VERLAG GMBH |
| 源URL | [http://ir.iccas.ac.cn/handle/121111/63363]  |
| 专题 | 中国科学院化学研究所 |
| 通讯作者 | Shuai, Zhigang |
| 作者单位 | Chinese Acad Sci, Inst Chem, Key Lab Organ Solids, Beijing Natl Lab Mol Sci BNLMS, Beijing 100080, Peoples R China |
| 推荐引用方式 GB/T 7714 | Yi, Yuanping,Zhu, Lingyun,Shuai, Zhigang. Theoretical designs of molecular photonics materials[J]. MACROMOLECULAR THEORY AND SIMULATIONS,2008,17(1):12-22. |
| APA | Yi, Yuanping,Zhu, Lingyun,&Shuai, Zhigang.(2008).Theoretical designs of molecular photonics materials.MACROMOLECULAR THEORY AND SIMULATIONS,17(1),12-22. |
| MLA | Yi, Yuanping,et al."Theoretical designs of molecular photonics materials".MACROMOLECULAR THEORY AND SIMULATIONS 17.1(2008):12-22. |
入库方式： OAI收割
来源：化学研究所
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