Theoretical Study on the Structural Properties and Relative Stability of M(II)−Al Layered Double Hydroxides Based on a Cluster Model

2009 ◽  
Vol 113 (21) ◽  
pp. 6133-6141 ◽  
Author(s):  
Hong Yan ◽  
Min Wei ◽  
Jing Ma ◽  
Feng Li ◽  
David G. Evans ◽  
...  
Keyword(s):  
Structural Properties ◽  
Layered Double Hydroxides ◽  
Relative Stability ◽  
Cluster Model ◽  
Theoretical Study ◽  
Double Hydroxides

Theoretical Study of the Catalytic Performance of Activated Layered Double Hydroxides in the Cyanoethylation of Alcohols

2019 ◽  
Vol 123 (14) ◽  
pp. 8777-8784 ◽  
Author(s):  
Cristina Cuautli ◽  
Jaime S. Valente ◽  
J. C. Conesa ◽  
M. Verónica Ganduglia-Pirovano ◽  
Joel Ireta
Keyword(s):  
Layered Double Hydroxides ◽  
Theoretical Study ◽  
Catalytic Performance ◽  
Double Hydroxides

Investigation about iron(III) incorporation into layered double hydroxides: compositional and structural properties of Mg2FeyAl(1-y)(OH)6-Cl and Zn2FeyAl(1-y)(OH)6-Cl

2021 ◽  
pp. 161184
Author(s):  
Mariana Pires Figueiredo ◽  
Alfredo Duarte ◽  
Victor Vendruscolo ◽  
Rodolphe Thirouard ◽  
Vera R.L. Constantino ◽  
...  
Keyword(s):  
Structural Properties ◽  
Layered Double Hydroxides ◽  
Double Hydroxides

Theoretical Study on the Anisotropic Photo-Induced Carrier Mobilities in Layered Double Hydroxides-Based Photocatalysts

2021 ◽  
Author(s):  
Zi-Ru Chen ◽  
Yu-Quan Zhu ◽  
Si-Min Xu ◽  
Yufei Zhao ◽  
Qian Peng ◽  
...  
Keyword(s):  
Quantum Efficiency ◽  
Layered Double Hydroxides ◽  
Reaction Rate ◽  
Theoretical Study ◽  
Electron Hole ◽  
Photocatalysis Reaction ◽  
Double Hydroxides ◽  
Transportation Routes ◽  
Hole Recombination

In order to suppress the unwanted photo-induced electron-hole recombination which restricts the quantum efficiency and reaction rate of photocatalysis reaction, the transportation routes of electron and hole in photocatalyst should...

scholarly journals Theoretical study and analysis of o-nitrophenol adsorption using layered double hydroxides containing Ca-Al, Ni-Al and Zn-Al

2021 ◽  
Author(s):  
Lotfi Sellaoui ◽  
Amira Yazidi ◽  
Jawad Ali ◽  
Guilherme Luiz Dotto ◽  
Adrian Bonilla-Petriciolet ◽  
...  
Keyword(s):  
Layered Double Hydroxides ◽  
Theoretical Study ◽  
Double Hydroxides

Acceptorless amine dehydrogenation and transamination using Pd-doped layered double hydroxides

2018 ◽  
Author(s):  
Diana Ainembabazi ◽  
Nan An ◽  
Jinesh Manayil ◽  
Kare Wilson ◽  
Adam Lee ◽  
...  
Keyword(s):  
Layered Double Hydroxides ◽  
Oxidation States ◽  
Secondary Amines ◽  
Primary Amines ◽  
Acid Dissolution ◽  
Oxidative Amination ◽  
Strong Function ◽  
Excellent Activity ◽  
High Yields ◽  
Double Hydroxides

<div> <p>The synthesis, characterization, and activity of Pd-doped layered double hydroxides (Pd-LDHs) for for acceptorless amine dehydrogenation is reported. These multifunctional catalysts comprise Brønsted basic and Lewis acidic surface sites that stabilize Pd species in 0, 2+, and 4+ oxidation states. Pd speciation and corresponding cataytic performance is a strong function of metal loading. Excellent activity is observed for the oxidative transamination of primary amines and acceptorless dehydrogenation of secondary amines to secondary imines using a low Pd loading (0.5 mol%), without the need for oxidants. N-heterocycles, such as indoline, 1,2,3,4-tetrahydroquinoline, and piperidine, are dehydrogenated to the corresponding aromatics with high yields. The relative yields of secondary imines are proportional to the calculated free energy of reaction, while yields for oxidative amination correlate with the electrophilicity of primary imine intermediates. Reversible amine dehydrogenation and imine hydrogenation determine the relative imine:amine selectivity. Poisoning tests evidence that Pd-LDHs operate heterogeneously, with negligible metal leaching; catalysts can be regenerated by acid dissolution and re-precipitation.</p> </div> <br>

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