Structural analysis of dehydrated gibbsite-based layered double hydroxides Li–Al–X (X = F−, Cl−, Br−, I−, OH−, NO3−, CO32−, and SO42−) by DFT calculations-Reference-Cited by-同舟云学术

Structural analysis of dehydrated gibbsite-based layered double hydroxides Li–Al–X (X = F−, Cl−, Br−, I−, OH−, NO3−, CO32−, and SO42−) by DFT calculations

Published:2020 Issue:24 Volume:44 Page:10137-10145
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Barbosa Anna Carolina de A.¹²³⁴,Fonseca Carla G.¹²³⁴^ORCID,Wypych Fernando⁵⁶⁷⁴^ORCID,Leitão Alexandre A.¹²³⁴^ORCID

Affiliation:

1. Chemistry Department

2. Federal University of Juiz de Fora

3. Juiz de Fora – MG

4. Brazil

5. CEPESQ – Research Center in Applied Chemistry – Chemistry Department

6. Federal University of Paraná

7. Curitiba – PR

Abstract

Ab initio calculations were performed in order to discuss the structural modifications derived from anion exchange in Li–Al–Cl LDH, a compound formed by the treatment of gibbsite with aqueous lithium chloride (LiCl).

Funder

Financiadora de Estudos e Projetos

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

Fundação de Amparo à Pesquisa do Estado de Minas Gerais

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Petrobras

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2020/NJ/C9NJ06454K

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