Skeletal relaxation effect on the charge transfer state formation of 4-dimethylamino,4′-cyanostilbene

Journal of Physical Chemistry A

Volumn 110, Issue 28, 2006, Pages 8736-8743

  Amatatsu, Yoshiaki ^a  

^a AKITA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE; CONTINUUM MECHANICS; DECOMPOSITION; ELECTRONS; ELECTROSTATIC DEVICES; POLARIZATION; SOLVENTS; TORSIONAL STRESS;

AROMATIC BENZENE RINGS; COMPLETE ACTIVE SPACE SELF-CONSISTENT FIELD (CASSCF); ELECTROSTATIC INTERACTION; POLARIZED CONTINUUM MODEL (PCM);

CHARGE TRANSFER;

EID: 33746885113     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp061310s     Document Type: Article

References (20)

1. Amatatsu, Y. J. Phys. Chem. A 2005, 109, 7225-7235. The review on experiments and theory in therein.
2. Rotkiewicz, K.; Grellmann, K. H.; Grabowski, Z. R. Chem. Phys. Lett. 1973, 19, 315-318
3. Rettig, W.; Majenz, J. Chem. Phys. Lett. 1989, 154, 335-341.
4. Gilabert, E.; Lapouyade, R.; Rullière, C. Chem. Phys. Lett. 1991, 185, 82-87.
5. Lapouyade, R.; Czechka, K.; Majenz, W.; Rettig, W.; Gilabert, E.; Rullière, C. J. Phys. Chem. 1992, 96, 9643-9650.
6. Rettig, W.; Majeiz, W.; Herter, R.; Létard, J.-F.; Lapouyade, R. Pure Appl. Chem. 1993, 65, 1699-1704.
7. Rettig, W.; Gilabert, E.; Rullière, C. Chem. Phys. Lett. 1994, 229, 127-133.
8. Létard, J.-F.; Lapouyade, R.; Rettig, W. Chem. Phys. Lett. 1994, 229, 209-216.
9. König, N. E.; Kühne, T.; Schwarzer, D.; Vöhringer, P.; Schroeder, J. Chem. Phys. Lett. 1996, 253, 69-76.
10. Abraham, E.; Oberlé, J.; Jonusauskas, G.; Lapouyade, R.; Rullière, C. Chem. Phys. 1997, 214, 409-423.
11. Abraham, E.; Oberlé, J.; Jonusauskas, G.; Lapouyade, R.; Rullière, C. J. Photochem. Photobiol. A 1997, 105, 101-107.
12. Pines, D.; Pines, E.; Rettig W. J. Phys. Chem. A 2003, 107, 236-242.
13. Amatatsu, Y. Theor. Chem. Acc. 2000, 103, 445-450.
14. Amatatsu, Y. Chem. Phys. 2001, 274, 87-98.
15. Schmidt, M. W.; Baldridge, K. K.; Boatz, J. A.; Elbert, S. T.; Gordon, M. S.; Jensen, J. H.; Koseki, S.; Matsunaga, N.; Nguyen, K. A.; Su S. J.; Windus, T. L.; Dupuis, M.; Montgomery, J. A., Jr. J. Comput. Chem. 1993, 14, 1347-1363.
16. Arzhantsev, S.; Zachariasse, K. A.; Maroncelli, M. J. Phys. Chem. A 2006, 110, 3454-3470.
17. Amatatsu, Y. J. Comput. Chem. 2002, 23, 950-956.
18. Amatatsu, Y.; Hasebe, Y. J. Phys. Chem. A 2003, 107, 11169-11173.
19. Amatatsu, Y.; Hosokawa, M. J. Phys. Chem. A 2004, 108, 10238-10244.
20. Amatatsu, Y. J. Phys. Chem. A 2006, 110, 4479-4486.