Theoretical investigation on the one- and two-photon absorption properties for a series of symmetrical charge transfer fluorene-phenylene and fluorene-thiophene derivatives
文献类型：期刊论文
| 作者 | Ma WB(马文波) ; Wu YQ(吴谊群) ; Gu DH(顾冬红) ; Gan FX(干福熹) |
| 刊名 | theochem-j. mol. struct.
 |
| 出版日期 | 2006 |
| 卷号 | 772期号:1-3页码:81 |
| 关键词 | two-photon absorption fluorene derivatives three-state model ZINDO/S method |
| ISSN号 | 0166-1280 |
| 中文摘要 | one- and two-photon absorption properties of a series of fluorene derivatives with symmetrical charge transfer d-it-d and a-it-a structural motifs have been theoretically investigated with zindo/s method. the optimized structures and the characterization of frontier molecular orbitals were obtained by using ami calculations. two-photon absorption properties of molecules have been studied using three-state model. the calculation results have shown that fluorene-thiophene derivatives exhibit larger two-photon absorption cross-section as compared with other studied molecules. to illustrate the results, the crucial effects of thiophene ring on fluorenethiophene derivatives and the net charge changes on the pi-conjugated bridges are analyzed theoretically. (c) 2006 elsevier b.v. all rights reserved. |
| 学科主题 | 光存储 |
| 收录类别 | 0 |
| 语种 | 英语 |
| WOS记录号 | WOS:000241100100010 |
| 公开日期 | 2009-09-22 |
| 源URL | [http://ir.siom.ac.cn/handle/181231/3867]  |
| 专题 | 上海光学精密机械研究所_高密度光存储技术实验室 |
| 推荐引用方式 GB/T 7714 | Ma WB,Wu YQ,Gu DH,et al. Theoretical investigation on the one- and two-photon absorption properties for a series of symmetrical charge transfer fluorene-phenylene and fluorene-thiophene derivatives[J]. theochem-j. mol. struct.,2006,772(1-3):81, 87. |
| APA | 马文波,吴谊群,顾冬红,&干福熹.(2006).Theoretical investigation on the one- and two-photon absorption properties for a series of symmetrical charge transfer fluorene-phenylene and fluorene-thiophene derivatives.theochem-j. mol. struct.,772(1-3),81. |
| MLA | 马文波,et al."Theoretical investigation on the one- and two-photon absorption properties for a series of symmetrical charge transfer fluorene-phenylene and fluorene-thiophene derivatives".theochem-j. mol. struct. 772.1-3(2006):81. |
入库方式： OAI收割
来源：上海光学精密机械研究所
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