2019
DOI: 10.1016/j.ica.2019.119042
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Halide bridged novel ternary copper(I) complexes with bis imino-quinolinyl ligand and triphenylphosphine: Synthesis, structure, luminescence, electrochemistry and theoretical studies

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Cited by 6 publications
(1 citation statement)
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“…The geometries of the complexes in ground state were fully optimized using density functional theory (DFT) with the B3LYP hybrid exchange correlation functional. [33] The DFT (TD-DFT) calculations were performed on the subsequent structures by using the same method to understand the absorption transition. Through these calculations, a ''double-ζ'' quality basis set (LANL2DZ) was employed for Cu and I atoms, and C, H, O, N and P were described by 6-31G(d,p) basis set.…”
Section: X-ray Crystallographymentioning
confidence: 99%
“…The geometries of the complexes in ground state were fully optimized using density functional theory (DFT) with the B3LYP hybrid exchange correlation functional. [33] The DFT (TD-DFT) calculations were performed on the subsequent structures by using the same method to understand the absorption transition. Through these calculations, a ''double-ζ'' quality basis set (LANL2DZ) was employed for Cu and I atoms, and C, H, O, N and P were described by 6-31G(d,p) basis set.…”
Section: X-ray Crystallographymentioning
confidence: 99%