Theoretical studies on structures and spectroscopic properties of highly efficient phosphorescent iridium(III) complexes with pyrazine and pyrimidine ligands

Synthetic Metals

Volumn 161, Issue 21-22, 2011, Pages 2492-2497

  Zhang, Jian Po ^a   Jin, Li ^a   Zhang, Hong Xing ^b   Bai, Fu Quan ^b  

^a JILIN INSTITUTE OF CHEMICAL TECHNOLOGY   (China)

^b JILIN UNIVERSITY   (China)

Author keywords

Cyclometalated iridium(III) complexes; Electronic structures; OLED; Spectroscopic properties; TD DFT calculations

Indexed keywords

B3LYP/LANL2DZ; FRONTIER MOLECULAR ORBITALS; IRIDIUM COMPLEX; METAL ATOMS; N LIGANDS; OLED; PHOSPHORESCENT EMISSION; PYRAZINES; SPECTROSCOPIC PROPERTY; TD-DFT CALCULATIONS; THEORETICAL STUDY;

AROMATIC COMPOUNDS; CHARGE TRANSFER; CHEMICAL BONDS; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; GROUND STATE; ION EXCHANGE; IRIDIUM COMPOUNDS; LIGANDS; LIGHT EMISSION; MOLECULAR ORBITALS; PHOSPHORESCENCE;

IRIDIUM;

EID: 80055090926     PISSN: 03796779     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.synthmet.2011.09.039     Document Type: Article

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