Theoretical studies on the one-and two-photon absorption properties of azulenylporphyrins and azulene-fused porphyrins

被引：0

作者：

李文超 ^{[1
]}

封继康 ^{[1
,2
]}

任爱民 ^{[1
]}

张祥标 ^{[1
]}

孙家钟 ^{[1
]}

机构：

[1] State Key Laboratory of Theoretical and Computational Chemistry,Institute of Theoretical Chemistry,Jilin University

[2] College of Chemistry,Jilin University

来源：

Chinese Physics B | 2009年 / 18卷 / 06期

基金：

中国国家自然科学基金;

关键词：

porphyrin; azulene; two-photon absorption;

D O I：

暂无

中图分类号：

O437 [非线性光学（强光与物质的作用）];

学科分类号：

摘要：

The electronic structures, one-photon absorption (OPA) and two-photon absorption (TPA) properties of the azulenylporphyrins and azulene-fused porphyrins have been comparatively studied by using DFT/B3LYP/6-31G(d) and the ZINDO/SDCI method. With the number of azulenyl groups increasing, the OPA wavelengths of all molecules are red-shifted in 400–600 nm and the two-photon absorption cross section is gradually enlarged. The azulene-fused structures facilitate an expanding conjugated area and increasing TPA cross section. The origin of TPA properties of studied compounds is studied with a two-level model. In summary, the azulene-fused porphyrins exhibit strong two-photon absorption.

引用

页码：2271 / 2281

页数：11

共 50 条

[1] Theoretical studies on the one- and two-photon absorption properties of azulenylporphyrins and azulene-fused porphyrins
State Key Laboratory of Theoretical and Computational Chemistry, Institute of Theoretical Chemistry, Jilin University, Changchun 130023, China
不详
Chin. Phys., 2009, 6 (2271-2281):
[2] Theoretical studies on the one- and two-photon absorption properties of azulenylporphyrins and azulene-fused porphyrins
Li Wen-Chao
Feng Ji-Kang
Ren Ai-Min
Zhang Xiang-Biao
Sun Chia-Chung
CHINESE PHYSICS B, 2009, 18 (06) : 2271 - 2281
[3] A quadruply azulene-fused porphyrin with intense near-IR absorption and a large two-photon absorption cross section
Kurotobi, Kei
Kim, Kil Suk
Noh, Su Bum
Kim, Dongho
Osuka, Atsuhiro
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2006, 45 (24) : 3944 - 3947
[4] Molecular design and theoretical investigation into one-and two-photon absorption properties of two series of cyclometalated platinum(Ⅱ) complexes
YANG ZhaoDiZHANG GuiLingFENG JiKang REN AiMin Key Laboratory of Green Chemical Engineering and Technology of College of Heilongjiang Province
College of Chemical and Environmental EngineeringHarbin University of Science and TechnologyHarbin China State Key Laboratory of Theoretical and Computational Chemistry
Institute of Theoretical ChemistryJilin UniversityChangchun China
Science China(Chemistry), 2012, 55 (07) : 1423 - 1430
[5] Molecular design and theoretical investigation into one-and two-photon absorption properties of two series of cyclometalated platinum(Ⅱ) complexes
YANG ZhaoDi1
College of Chemical and Environmental Engineering
Institute of Theoretical Chemistry
Science China(Chemistry) , 2012, (07) : 1423 - 1430
[6] Theoretical investigation of one-photon and two-photon absorption properties for multiply N-confused porphyrins
Yang, Zhao-Di
Feng, Ji-Kang
Ren, Ai-Min
Sun, Chia-Chung
JOURNAL OF PHYSICAL CHEMISTRY A, 2006, 110 (51): : 13956 - 13965
[7] Two-photon absorption properties of substituted porphyrins
Shen, Liang
Wang, Xiaomei
Li, Bo
Jiang, Wanli
Yang, Ping
Qian, Shixiong
Tao, Xutang
Jiang, Minhua
JOURNAL OF PORPHYRINS AND PHTHALOCYANINES, 2006, 10 (03) : 160 - 166
[8] Theoretical studies on one-photon and two-photon absorption properties of a series of dibenzothiophene derivatives
Xing, Xiao-Juan
Li, Jing
Sun, Yu-Ping
Wang, Chuan-Kui
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2008, 849 (1-3): : 116 - 121
[9] Interplay of one-and two-step channels in electrovibrational two-photon absorption
Polyutov, S
Minkov, I
Gel'mukhanov, F
Agren, H
JOURNAL OF PHYSICAL CHEMISTRY A, 2005, 109 (42): : 9507 - 9513
[10] Theoretical studies on one- and two-photon absorption properties of rubrene and its derivatives
Zhao, Liang
Yang, Guochun
Su, Zhongmin
Qin, Chunsheng
Yang, Shuangyang
SYNTHETIC METALS, 2006, 156 (18-20) : 1218 - 1224

← 1 2 3 4 5 →