2015PolyhedronRequires access

Theoretical studies on the substituent effect on the photophysical properties of two series of heteroleptic Ir(III) complexes

Xiaohong Shang, Deming Han, Ling Yi Zhou, Ning Wan, Gang Zhang

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Key concepts: Chemistry, Substituent, Time-dependent density functional theory, Density functional theory, Phosphorescence, Molecular orbital, HOMO/LUMO, Quantum yield

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