Electronic and optical properties of facial tris(8‐hydroxyquinoline) aluminum derivatives

In this study, we substitute facial Alq3 with (‐Mg) in positions 7 and 5 as electron donating group (EDG) and (‐Cl), (‐P) and (‐S) in position 7 as electron withdrawing groups (EWD). The ground and the first excited states geometries of facial Alq3 and their derivatives are optimized using B3lyp/6‐3...

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Veröffentlicht in:	Vietnam journal of chemistry 2023-02, Vol.61 (1), p.101-108
Hauptverfasser:	Abdelfettah, Bakadi, Abderrachid, Helmaoui
Format:	Artikel
Sprache:	eng
Schlagworte:	absorption DFT emission Fac‐Alq3 molecular orbital
Online-Zugang:	Volltext
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