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Computational & theoretical chemistry, v.1095, 2016년, pp.44 - 53
Zhang, Z. , Zhang, G. , Wang, J. , Sun, S. , Zhang, Z.
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An anilino substituted rhodamine analogue named 9-(2'-carboxyphenyl)-6-(N,N-diethylamino)-4-(n-phenyl-methanamine)-1,2,3-trihydroxanthylium (1) is investigated by DFT/TDDFT approaches to map its Large Stokes Shift (LSS) and Fluorescence Quantum Yields (FQY) mechanisms. According to PES analysis, bot...
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