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Time-Dependent Afterglow Color in a Single-Component Organic Molecular Crystal
Authors:Jian-Xin Wang  Ye-Guang Fang  Chun-Xiang Li  Li-Ya Niu  Wei-Hai Fang  Ganglong Cui  Qing-Zheng Yang
Institution:1. Institution Key Laboratory of Radiopharmaceuticals, College of Chemistry, Beijing Normal University, Beijing, 100875 P. R. China

These authors contributed equally to this work.;2. Key Laboratory of Theoretical and Computational Photochemistry, Ministry of Education, College of Chemistry, Beijing Normal University, Beijing, 100875 P. R. China

These authors contributed equally to this work.;3. Key Laboratory of Theoretical and Computational Photochemistry, Ministry of Education, College of Chemistry, Beijing Normal University, Beijing, 100875 P. R. China;4. Institution Key Laboratory of Radiopharmaceuticals, College of Chemistry, Beijing Normal University, Beijing, 100875 P. R. China

Abstract:An organic crystal of 4,4′-bis(N-carbazolyl)-1,1′-biphenyl (pCBP) exhibits time-dependent afterglow color from blue to orange over 1 s. Both experimental and computational data confirm that the color evolution results from well-separated, long-persistent thermally activated delayed fluorescence (TADF) and room-temperature phosphorescence (RTP) with different but comparable decay rates. TADF is enabled by a small S1–T1 energy gap of 0.7 kcal mol?1. The good separation of TADF and RTP is due to a 11.8 kcal mol?1 difference in the S0 energies of the S1 and T1 structures, indicating that apart from the excited-state properties, tuning the ground state is also important for luminescence properties. This afterglow color evolution of pCBP allows its applications in anticounterfeiting and data encryption with high security levels.
Keywords:Datenverschlüsselung  Anhaltende RTP  Phosphoreszenz  Thermisch aktivierte verzögerte Fluoreszenz
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