Very large infrared two-photon absorption cross section of asymmetric zinc porphyrin aggregates: Role of intermolecular interaction and donor-acceptor strengths

被引:49
作者
Ray, Paresh Chandra [1 ]
Sainudeen, Zuhail [1 ]
机构
[1] Jackson State Univ, Dept Chem, Jackson, MS 39217 USA
关键词
D O I
10.1021/jp063930z
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Very large two-photon absorption (TPA) cross sections at the infrared region have been revealed for J-aggregates of asymmetric zinc porphyrin using quantum-chemical calculation. The TPA properties are evaluated for monomer and aggregates of a series of push-pull porphyrins, whose syntheses are known in the literature. The two-photon absorption cross section can be greatly enhanced by increasing the strengths of the electron donor/acceptor. We also present a quantum-chemical analysis on porphyrin aggregates to understand the role of intermolecular interactions and the relationship between structural and collective nonlinear optical properties. It has been observed that the TPA properties change tremendously as monomers undergo J-aggregation and the magnitudes of TPA cross sections are highly dependent on the nature of aggregates. The importance of our results with respect to the design of photonic and photodynamic therapy materials has been discussed.
引用
收藏
页码:12342 / 12347
页数:6
相关论文
共 55 条
[1]   Relationship between two-photon absorption and the π-conjugation pathway in porphyrin arrays through dihedral angle control [J].
Ahn, TK ;
Kim, KS ;
Kim, DY ;
Noh, SB ;
Aratani, N ;
Ikeda, C ;
Osuka, A ;
Kim, D .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2006, 128 (05) :1700-1704
[2]   Comparative photophysics of [26]- and [28]hexaphyrins(1.1.1.1.1.1): Large two-photon absorption cross section of aromatic [26]hexaphyrins(1.1.1.1.1.1) [J].
Ahn, TK ;
Kwon, JH ;
Kim, DY ;
Cho, DW ;
Jeong, DH ;
Kim, SK ;
Suzuki, M ;
Shimizu, S ;
Osuka, A ;
Kim, D .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2005, 127 (37) :12856-12861
[3]   Design of organic molecules with large two-photon absorption cross sections [J].
Albota, M ;
Beljonne, D ;
Brédas, JL ;
Ehrlich, JE ;
Fu, JY ;
Heikal, AA ;
Hess, SE ;
Kogej, T ;
Levin, MD ;
Marder, SR ;
McCord-Maughon, D ;
Perry, JW ;
Röckel, H ;
Rumi, M ;
Subramaniam, C ;
Webb, WW ;
Wu, XL ;
Xu, C .
SCIENCE, 1998, 281 (5383) :1653-1656
[4]   Role of donor-acceptor strengths and separation on the two-photon absorption response of cytotoxic dyes: A TD-DFT study [J].
Badaeva, EA ;
Timofeeva, TV ;
Masunov, AM ;
Tretiak, S .
JOURNAL OF PHYSICAL CHEMISTRY A, 2005, 109 (32) :7276-7284
[5]   Two-photon absorption in three-dimensional chromophores based on [2.2]-paracyclophane [J].
Bartholomew, GP ;
Rumi, M ;
Pond, SJK ;
Perry, JW ;
Tretiak, S ;
Bazan, GC .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2004, 126 (37) :11529-11542
[6]  
Bauer C, 2002, ADV MATER, V14, P673, DOI 10.1002/1521-4095(20020503)14:9<673::AID-ADMA673>3.0.CO
[7]  
2-F
[8]   Two-photon absorption at telecommunications wavelengths in a dipolar chromophore with a pyrrole auxiliary donor and thiazole auxiliary acceptor [J].
Beverina, L ;
Fu, J ;
Leclercq, A ;
Zojer, E ;
Pacher, P ;
Barlow, S ;
Van Stryland, EW ;
Hagan, DJ ;
Brédas, JL ;
Marder, SR .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2005, 127 (20) :7282-7283
[9]  
Bhawalkar J D, 1997, J Clin Laser Med Surg, V15, P201
[10]   Assessment of conventional density functional schemes for computing the dipole moment and (hyper)polarizabilities of push-pull π-conjugated systems [J].
Champagne, B ;
Perpète, EA ;
Jacquemin, D ;
van Gisbergen, SJA ;
Baerends, EJ ;
Soubra-Ghaoui, C ;
Robins, KA ;
Kirtman, B .
JOURNAL OF PHYSICAL CHEMISTRY A, 2000, 104 (20) :4755-4763