Spectroscopy and Spectral Analysis, Volume. 35, Issue 3, 674(2015)
Quantum Chemistry Calculation of Ponceau 4R Molecule Structure and Research on the Fluorescence Mechanism
[2] [2] Tsuda S, Murakami M, Matsusaka N, et al. Toxicol. Sci., 2001, 61(1): 92.
[3] [3] Chung K T, Cerniglia C E. Murat. Res., 1992, 277(3): 201.
[4] [4] King C M, Land S J, Jones R F, et al. Mutat. Res., 1997, 376(1-2): 123.
[12] [12] Parr R G, Yang W. Density-Functional Theory of Atoms and Molecules. New York: Oxford University Press, 1989. 47.
[13] [13] Salahub D R, Zerner M C. The Challenge of d and f Electrons. ACS: Washington D. C, 1989.
[14] [14] Sundholm D. Phys. Chem. Chem. Phys., 2003, 5: 4265.
[15] [15] Hehre W J, Radon L, Pople J. A. Ab Initio Molecular Orbital Theory. New York: John Wiley & Sons, 1986: 226.
[16] [16] Cossi M, Barone V, Cammi R, et al. Chem. Phys. Lett., 1996, 255(4-6): 327.
[17] [17] Sundholm D. Chem. Phys. Lett., 2000, 317: 392.
[18] [18] Frisch M J, Trucks G W, Schlegel H B, et al. Gaussian 09 Revision B. 01, Wallingford CT: Gaussian Inc., 2010.
[19] [19] Gordon M S, Binkley J S, Pople J A, et al. J. Am. Chem. Soc., 1982, 104: 2797.
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ZHU Chun, ZHANG Yong, WU Jian-chun, ZHU Tuo, CHEN Guo-qing. Quantum Chemistry Calculation of Ponceau 4R Molecule Structure and Research on the Fluorescence Mechanism[J]. Spectroscopy and Spectral Analysis, 2015, 35(3): 674
Received: Feb. 25, 2014
Accepted: --
Published Online: May. 21, 2015
The Author Email: Chun ZHU (chunzhu1979@hotmail.com)