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Publication : international journal of quantum chemistry

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Academic Journal

Tuning the photophysical properties of BODIPY dyes used in DSSCs as predicted by double‐hybrid TD‐DFT: The role of the methyl substituents.

Authors : Helal, Wissam¹ (AUTHOR) ; Marashdeh, Ali^2,3 (AUTHOR); Alkhatib, Qabas¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. 12/15/2022, Vol. 122 Issue 24, p1-16. 16p.

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Academic Journal

Theoretical study of 8‐hydroxyquinoline derivatives as potential antennas in lanthanide complexes: Photophysical properties and elucidation of energy transfer pathways.

Authors : Santoyo‐Flores, Juan Julián¹ (AUTHOR); Páez‐Hernández, Dayán² (AUTHOR)

Source: International Journal of Quantum Chemistry. 5/15/2022, Vol. 122 Issue 10, p1-10. 10p.

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Academic Journal

A multiscale study on photophysical properties of a novel fluorescent probe for imaging amyloid‐β in Alzheimer's disease.

Authors : Zhang, Yujin¹ (AUTHOR); Leng, Jiancai¹ (AUTHOR) ; Hu, Wei¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. Sep2020, Vol. 120 Issue 18, p1-10. 10p.

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Academic Journal

Photophysical properties of the isomorphic emissive RNA nucleobase analogues and effect of water solution, ribose, and base pairing: A theoretical study.

Authors : Zhang, Laibin¹ ; Kong, Xiangmu¹ ; Wang, Mei¹

Source: International Journal of Quantum Chemistry. 6/15/2017, Vol. 117 Issue 13, pn/a-N.PAG. 12p.

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Academic Journal

Effects of heterocyclic ring and amino‐ethyl‐amino group on the electronic and photophysical properties of a triphenylamine‐pyrimidine dye.

Authors : Yang, Jieqiong¹ (AUTHOR); Liu, Dongzhi¹ (AUTHOR); Lu, Ting¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. Oct2020, Vol. 120 Issue 19, p1-11. 11p.

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Academic Journal

DFT/TDDFT studies of the ancillary ligand effects on structures and photophysical properties of rhenium (I) tricarbonyl complexes with the imidazo[4,5-f]-1,10-phenanthroline ligand.

Authors : Yang, Xiao ‐ Zhu¹; Zhang, Ting ‐ Ting¹; Wei, Jia¹

Source: International Journal of Quantum Chemistry. Oct2015, Vol. 115 Issue 20, p1467-1474. 8p.

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Academic Journal

Theoretical investigations on electronic structures and photophysical properties of novel bridged triphenylamine derivatives.

Authors : Zhang, Zi‐Long¹ (AUTHOR); Zou, Lu‐Yi¹ (AUTHOR); Ren, Ai‐Min¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. Mar2012, Vol. 112 Issue 5, p1473-1490. 18p.

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Theoretical study on photophysical properties of novel bis(BF2)-2,2′-bidipyrrins dyes: Effect of variation in monomer structure.

Authors : Jin, J. L.¹ (AUTHOR); Wu, S. X.¹ (AUTHOR); Geng, Y.¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. Jan2012, Vol. 112 Issue 2, p440-452. 13p.

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Academic Journal

Spectroscopic and photophysical properties of dicopper(I) metallocyclophanes.

Authors : Burke, Luke A.¹ (AUTHOR) ; Heirtzler, Fenton¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. 2010, Vol. 110 Issue 15, p3061-3071. 11p. 5 Diagrams, 3 Charts.

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Exploring the potential of tetraazaacene derivatives as photovoltaic materials with enhanced photovoltaic parameters.

Authors : Fatima, Rida¹ (AUTHOR); Shehzad, Rao Aqil¹ (AUTHOR); Rasool, Alvina¹ (AUTHOR)

Source: International Journal of Quantum Chemistry. 1/5/2022, Vol. 122 Issue 1, p1-12. 12p.

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نتائج البحث

فلترة النتائج

Tuning the photophysical properties of BODIPY dyes used in DSSCs as predicted by double‐hybrid TD‐DFT: The role of the methyl substituents.

Theoretical study of 8‐hydroxyquinoline derivatives as potential antennas in lanthanide complexes: Photophysical properties and elucidation of energy transfer pathways.

A multiscale study on photophysical properties of a novel fluorescent probe for imaging amyloid‐β in Alzheimer's disease.

Photophysical properties of the isomorphic emissive RNA nucleobase analogues and effect of water solution, ribose, and base pairing: A theoretical study.

Effects of heterocyclic ring and amino‐ethyl‐amino group on the electronic and photophysical properties of a triphenylamine‐pyrimidine dye.

DFT/TDDFT studies of the ancillary ligand effects on structures and photophysical properties of rhenium (I) tricarbonyl complexes with the imidazo[4,5-f]-1,10-phenanthroline ligand.

Theoretical investigations on electronic structures and photophysical properties of novel bridged triphenylamine derivatives.

Theoretical study on photophysical properties of novel bis(BF2)-2,2′-bidipyrrins dyes: Effect of variation in monomer structure.

Spectroscopic and photophysical properties of dicopper(I) metallocyclophanes.

Exploring the potential of tetraazaacene derivatives as photovoltaic materials with enhanced photovoltaic parameters.

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