scholarly journals DFT study of superhalogen and superalkali doped graphitic carbon nitride and its non-linear optical properties

RSC Advances ◽  
2021 ◽  
Vol 11 (14) ◽  
pp. 7779-7789 ◽  
Author(s):  
Asmat Ullah Khan ◽  
Rasheed Ahmad Khera ◽  
Naveed Anjum ◽  
Rao Aqil Shehzad ◽  
Saleem Iqbal ◽  
...  
Keyword(s):  
Optical Properties ◽  
Dft Calculations ◽  
Nonlinear Optical ◽  
Carbon Nitride ◽  
Graphitic Carbon ◽  
Graphitic Carbon Nitride ◽  
Dft Study ◽  
Nlo Properties ◽  
Non Linear ◽  
Linear Optical Properties

DFT calculations are carried out to investigate nonlinear optical (NLO) properties of superhalogen (BCl4) and superalkali (NLi4) doped graphitic carbon nitride (GCN).

scholarly journals Wavelength dependent nonlinear optical response of tetraphenylethene aggregation-induced emission luminogens

2018 ◽  
Vol 2 (12) ◽  
pp. 2263-2271 ◽  
Author(s):  
Jianbo Xiong ◽  
Xinyue Li ◽  
Chunqing Yuan ◽  
Sergey Semin ◽  
Zhaoquan Yao ◽  
...  
Keyword(s):  
Optical Properties ◽  
Nonlinear Optical ◽  
Theoretical Calculations ◽  
Experimental Results ◽  
Nlo Properties ◽  
Aggregation Induced Emission ◽  
Non Linear ◽  
Potential Applications ◽  
Linear Optical Properties ◽  
Linear Optical

Studies of the non-linear optical properties of classical AIEgens are rare, despite their important potential applications in organic composite photonic circuits. Here, we present experimental results, supported by theoretical calculations, of the non-linear optical (NLO) properties of TPE and its halogenated derivates.

Non-linear optical properties of gold quantum clusters. The smaller the better

Nanoscale ◽  
2014 ◽  
Vol 6 (22) ◽  
pp. 13572-13578 ◽  
Author(s):  
Isabelle Russier-Antoine ◽  
Franck Bertorelle ◽  
Marin Vojkovic ◽  
Driss Rayane ◽  
Estelle Salmon ◽  
...  
Keyword(s):  
Optical Properties ◽  
Nonlinear Optical ◽  
New Method ◽  
Photon Absorption ◽  
Nlo Properties ◽  
Two Photon Absorption ◽  
Two Photon ◽  
Non Linear ◽  
Quantum Clusters ◽  
Linear Optical Properties

We developed a new method for synthesizing atomically monodisperse Au15 nanoclusters stabilized with glutathione molecules, and investigated their nonlinear optical (NLO) properties after two-photon absorption.

Band gap-tunable potassium doped graphitic carbon nitride with enhanced mineralization ability

2015 ◽  
Vol 44 (3) ◽  
pp. 1084-1092 ◽  
Author(s):  
Shaozheng Hu ◽  
Fayun Li ◽  
Zhiping Fan ◽  
Fei Wang ◽  
Yanfeng Zhao ◽  
...  
Keyword(s):  
Optical Properties ◽  
Photocatalytic Degradation ◽  
Crystal Lattice ◽  
Band Gap ◽  
Carbon Nitride ◽  
Graphitic Carbon ◽  
Graphitic Carbon Nitride ◽  
Structural And Optical Properties

Potassium doped into the g-C3N4 crystal lattice can tune the positions of the CB and VB potentials, influence the structural and optical properties and thus improve the photocatalytic degradation and mineralization ability.

Optical and nonlinear optical properties of Ln(Tp)2, where Ln = La,…,Lu and Tp = tris(pyrazolyl)borate: a DFT+TD-DFT study

2019 ◽  
Vol 43 (36) ◽  
pp. 14377-14389 ◽  
Author(s):  
Douniazed Hannachi ◽  
Mohamed Fahim Haroun ◽  
Ahlem Khireddine ◽  
Henry Chermette
Keyword(s):  
Optical Properties ◽  
Thermodynamic Properties ◽  
Dft Calculations ◽  
Rare Earths ◽  
Magnetic Moment ◽  
Nonlinear Optical ◽  
Dft Study ◽  
Dynamic Polarizability ◽  
Td Dft ◽  
Borate Complexes

DFT calculations of electronic, structural, thermodynamic properties, magnetic moment, static and dynamic polarizability and hyperpolarizability of Ln(Tp)2 (Ln = rare earths, Tp = ring-unsubstituted tris(pyrazolyl)borate) complexes.

Electrochemical CO 2 Reduction to C 1 Products on Single Nickel/Cobalt/Iron‐Doped Graphitic Carbon Nitride: A DFT Study

ChemSusChem ◽  
2019 ◽  
Vol 12 (23) ◽  
pp. 5126-5132 ◽  
Author(s):  
Chen Guo ◽  
Tian Zhang ◽  
Xiangxuan Deng ◽  
Xiongyi Liang ◽  
Wenyue Guo ◽  
...  
Keyword(s):  
Carbon Nitride ◽  
Graphitic Carbon ◽  
Graphitic Carbon Nitride ◽  
Dft Study ◽  
Nickel Cobalt ◽  
Cobalt Iron ◽  
Iron Doped

Computational studies on magnetism and the optical properties of transition metal embedded graphitic carbon nitride sheets

2014 ◽  
Vol 2 (37) ◽  
pp. 7943-7951 ◽  
Author(s):  
Dibyajyoti Ghosh ◽  
Ganga Periyasamy ◽  
Bradraj Pandey ◽  
Swapan K. Pati
Keyword(s):  
Optical Properties ◽  
Transition Metal ◽  
Carbon Nitride ◽  
Graphitic Carbon ◽  
Graphitic Carbon Nitride ◽  
Computational Studies ◽  
Memory Devices

Transition metal embedded g-C3N4 sheets demonstrate promising multi usage in various fields such as memory devices, photocatalysis.

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