scholarly journals Scandium Complexes Bearing Bis(oxazolinylphenyl)amide Ligands: An Analysis of Their Reactivity, Solution-State Structures and Photophysical Properties

2016 ◽  
Vol 2016 (18) ◽  
pp. 2932-2941 ◽  
Author(s):  
Stacey D. Bennett ◽  
Simon J. A. Pope ◽  
Robert L. Jenkins ◽  
Benjamin D. Ward
Keyword(s):  
Photophysical Properties ◽  
Solution State ◽  
Amide Ligands

scholarly journals Correction: Red phosphorescent binuclear Pt(ii) complexes incorporating bis(diphenylphorothioyl)amide ligands: synthesis, photophysical properties and application in solution processable OLEDs

2021 ◽  
Vol 9 (38) ◽  
pp. 13522-13523
Author(s):  
Xia Suo ◽  
Chuanli Nie ◽  
Weiqiang Liu ◽  
Yuzhen Zhang ◽  
Yunjun Shen ◽  
...  
Keyword(s):  
Photophysical Properties ◽  
Amide Ligands ◽  
Solution Processable

Correction for ‘Red phosphorescent binuclear Pt(ii) complexes incorporating bis(diphenylphorothioyl)amide ligands: synthesis, photophysical properties and application in solution processable OLEDs’ by Xia Suo et al., J. Mater. Chem. C, 2021, 9, 9505–9514, DOI: 10.1039/D1TC02087K.

scholarly journals Theoretical insight into the photophysical properties of five phosphorescent heteroleptic iridium(iii) complexes bearing oxadiazol-substituted amide ligands

2019 ◽  
Vol 18 (5) ◽  
pp. 1075-1080 ◽  
Author(s):  
Xiaohong Shang ◽  
Deming Han ◽  
Lihui Zhao ◽  
Leijiao Li ◽  
Shuhui Lv
Keyword(s):  
Photophysical Properties ◽  
Structure Property ◽  
Structure Property Relationships ◽  
Amide Ligands ◽  
Theoretical Insight ◽  
Insight Into

A DFT/TDDFT study on the photophysical properties of five heteroleptic iridium(iii) complexes have been performed to obtain a better understanding of structure–property relationships.

Assembly, structures, photophysical properties and photocatalytic activities of a series of coordination polymers constructed from semi-rigid bis-pyridyl-bis-amide and benzenetricarboxylic acid

2015 ◽  
Vol 2 (4) ◽  
pp. 373-387 ◽  
Author(s):  
Xiuli Wang ◽  
Mao Le ◽  
Hong-Yan Lin ◽  
Jian Luan ◽  
Guo-Cheng Liu ◽  
...  
Keyword(s):  
Coordination Polymers ◽  
Photophysical Properties ◽  
Photocatalytic Properties ◽  
Fluorescence Sensing ◽  
Amide Ligands ◽  
Photocatalytic Activities ◽  
Metal Organic ◽  
Benzenetricarboxylic Acid

Ten metal–organic coordination polymers 1–10 based on semi-rigid bis-pyridyl-bis-amide ligands have been synthesized. The fluorescence sensing and photocatalytic properties of 1–10 have been investigated.

Red Phosphorescent Binuclear Pt(Ⅱ) Complexes Incorporating bis(diphenylphorothioyl)amide Ligands: Synthesis, Photophysical Properties and Application in Solution Processible OLEDs

2021 ◽  
Author(s):  
Xia Suo ◽  
Chuanli Nie ◽  
Weiqiang Liu ◽  
Yuzhen Zhang ◽  
yunjun shen ◽  
...  
Keyword(s):  
Photophysical Properties ◽  
Amide Ligands

Stable and efficient red phosphorescent materials are insistently demanded for their importance in the application in OLEDs. In this article, we report the syntheses, characterization, and photophysical properties of three...

Solvent Dependence of Structural Dynamics and Spin-flip Processes in 3,4,5-tri(9H-carbazole-9-yl)benzonitrile (ortho-3CzBN)

2020 ◽  
Author(s):  
Masaki Saigo ◽  
Kiyoshi Miyata ◽  
Hajime Nakanotani ◽  
Chihaya Adachi ◽  
Ken Onda
Keyword(s):  
Dft Calculations ◽  
Excited States ◽  
Structural Changes ◽  
Photophysical Properties ◽  
Delayed Fluorescence ◽  
Time Resolved ◽  
Thermally Activated Delayed Fluorescence ◽  
Thermally Activated ◽  
Solvent Dependence ◽  
Acetonitrile Solutions

We have investigated the solvent-dependence of structural changes along with intersystem crossing of a thermally activated delayed fluorescence (TADF) molecule, 3,4,5-tri(9H-carbazole-9-yl)benzonitrile (o-3CzBN), in toluene, tetrahydrofuran, and acetonitrile solutions using time-resolved infrared (TR-IR) spectroscopy and DFT calculations. We found that the geometries of the S1 and T1 states are very similar in all solvents though the photophysical properties mostly depend on the solvent. In addition, the time-dependent DFT calculations based on these geometries suggested that the thermally activated delayed fluorescence process of o-3CzBN is governed more by the higher-lying excited states than by the structural changes in the excited states.<br>

Theoretical Framework of 1,3-Thiazolium-5-Thiolates Mesoionic Compounds: Exploring the Nature of Photophysical Properties and Molecular Nonlinearity

2020 ◽  
Author(s):  
Zeyu Liu ◽  
Shugui Hua ◽  
Tian Lu ◽  
Ziqi Tian
Keyword(s):  
Optical Properties ◽  
Rational Design ◽  
Rayleigh Scattering ◽  
Function Analysis ◽  
Theoretical Calculations ◽  
Photophysical Properties ◽  
Optical Nonlinearity ◽  
Nonlinear Properties ◽  
Photoelectric Performance ◽  
Wave Function Analysis

Inspired by a previous experimental study on the first-order hyperpolarizabilities of 1,3-thiazolium-5-thiolates mesoionic compounds using Hyper-Rayleigh scattering technique, we theoretically investigated the UV-Vis absorption spectra and every order polarizabilities of these mesoionic molecules. Based on the fact that the photophysical and nonlinear properties observed in the experiment can be perfectly replicated, our theoretical calculations explored the essential characteristics of the optical properties of the mesoionic compounds with different electron-donating groups at the level of electronic structures through various wave function analysis methods. The influence of the electron-donating ability of the donor on the optical properties of the molecules and the contribution of the mesoionic ring moiety to their optical nonlinearity are clarified, which have not been reported by any research so far. This work will help people understand the nature of optical properties of mesoionic-based molecules and provide guidance for the rational design of molecules with excellent photoelectric performance in the future.

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