Acidity and stability of Nb(V) active sites doped in SBA-15 and ZrSBA-15: A DFT study

Acidity and stability of Nb(V) active sites doped in SBA-15 and ZrSBA-15: A DFT study

Mesoporous silicas are of great interest in heterogeneous catalysis due to the structural characteristics of their pores and the adjustable catalytic properties that arise from incorporating heteroatoms. The substitution of Zr and Nb into SBA-15 introduces active sites into the material, rendering i...

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Bibliographic Details
Main Authors: Gabriel Pereira da Silva, Daví Alexsandro Cardoso Ferreira, Rosenira Serpa da Cruz, Fernando Cesário Rangel
Format: Article
Language:English
Published: Elsevier 2024-10-01
Series:Results in Chemistry
Subjects:
Acid catalysis
Computational chemistry
Clusters
Ammonia adsorption
Mesoporous silica
Online Access:http://www.sciencedirect.com/science/article/pii/S2211715624005101

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http://www.sciencedirect.com/science/article/pii/S2211715624005101

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