First principle treatments on site- and size-dependent super-molecular interactions and nonlinear optical properties of polymer of 2-methyl-4-nitroaniline

Journal of Physical Chemistry B

Volumn 108, Issue 34, 2004, Pages 12658-12664

  Cheng, W D ^a   Wu, D S ^a   Zhang, H ^a   Li, X D ^a   Chen, D G ^a   Lang, Y Z ^a   Zhang, Y C ^a   Gong, Y J ^a  

^a FUJIAN INSTITUTE OF RESEARCH ON THE STRUCTURE OF MATTER   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC ABSORPTION SPECTRA; MOLECULAR ASSEMBLIES; OPTICAL RESPONSES; POLARIZABILITIES;

ABSORPTION SPECTROSCOPY; CHARGE TRANSFER; CRYSTALLINE MATERIALS; HYDROGEN BONDS; MONOMERS; NONLINEAR OPTICS; PHOTONS;

DIMERS;

EID: 4444336333     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0374096     Document Type: Article

References (23)

1. Lipscomb, G. F.; Garito, A. F.; Narang, R. S. J. Chem. Phys. 1981, 75, 1509.
2. Levine, B. F.; Bethea, C. G.; Thurmond, C. D.; Lynch, R. T.; Bernstern, J. L. J. Appl. Phys. 1979, 50, 2523.
3. White, J. D.; Hulin, D.; Joffre, M.; Migus, A.; Antonetti, A.; Toussaere, E.; Hierle, R.; Zyss, J. Appl. Phys. Lett. 1995, 64, 264.
4. Xu, J.; Zhou, L.; Thakur, M. Appl. Phys. Lett. 1998, 72, 153.
5. Gauvin, S.; Zyss, J. J. Cryst. Growth 1995, 166, 507.
6. Damman, P.; Vallee, R.; Dosiere, M.; Toussaere, E.; Zyss, J. Synth. Met. 2001, 124, 227.
7. Vallee, R.; Damman, P.; Dosiere, M.; Toussaere, E.; Zyss, J. J. Am. Chem. Soc. 2000, 122, 6701.
8. Choi, J.; Aggarwal, M. D.; Wang, W. S. J. Korean Phys. Soc. 1998, 32, S1234.
9. Goeta, A. E.; Wilson, C. C.; Autino, J. C.; Ellena, J.; Punte, G. Chem. Mater. 2000, 12, 3342.
10. Bella, S. D.; Ratner, M. A.; Marks, T. J. J. Am. Chem. Soc. 1992, 114, 5842.
11. Casida, M. E.; Jamorski, C.; Casida, K. C.; Salahub, D. R. J. Chem. Phys. 1988, 180, 4439.
12. Bauernschmitt, R.; Ahlrichs, R. Chem. Phys. Lett. 1996, 256, 454.
13. Stratman, R. E.; Scuseria, G. E.; Frisch, M. J. J. Chem. Phys. 1998, 109, 8218.
14. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98; Gaussian, Inc.: Pittsburgh, PA, 1998.
15. Gross, E. K. U.; Kohn, W. Adv. Quantum Chem. 1990, 27, 255.
16. Runge, E.; Gross, E. K. U. Phys. Rev. Lett. 1984, 52, 977.
17. Ward, J. F. Rev. Mod. Phys. 1965, 37, 1.
18. Orr, B. J.; Ward, J. F. Mol. Phys. 1971, 20, 513.
19. Ferguson, G.; Glidewell, C.; Low, J. N.; Skakle, M. S.; Wardell, J. L.; Acta Crystallogr. 2001, C57, 315.
20. Zyss, J. In Nonlinear Optics; Miyata, S., Ed.; Elsevier Science: Amsterdam, 1992; p 33.
21. Wu, K.; Snijders, J. G.; Lin, S. J. Phys. Chem. B 2002, 106, 8954.
22. Zhang, K.-C.; Wang, X.-M. Nonlinear Optical Crystal Material Sciences; Kexue Publishers: Beijing, 1996; p 302.
23. Boy, R. W. Nonlinear Optics; Academic Press: San Diego, CA, 1992; p 148.