均三甲苯
萘
苯
化学
基态
光化学
电荷转移复合物
二甲苯
计算化学
有机化学
物理
量子力学
作者
Chidambar Kulkarni,Ganga Periyasamy,Sundaram Balasubramanian,Subi J. George
摘要
Naphthalene diimides (NDIs) form emissive ground-state charge-transfer (CT) complexes with various electron rich aromatic solvents like benzene, o-xylene and mesitylene. TD-DFT calculation of the complexes suggests CT interaction and accounts for the observed ground-state changes.
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