The effect of vacancy defects on the adsorption of methane on calcite 104 surface

Berdiyorov, Golibjon; Elbashier, Elkhansa; Carchini, Giuliano; Sakhaee‐Pour, A.

doi:10.1016/j.jmrt.2021.08.091

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Understanding Of Defects In Catalytic Methane Combustion1

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2022

2024

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Cited by 4 publications

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“…It has been proposed through experiments and theoretical calculations that reactants are preferentially adsorbed at defect sites (such as oxygen vacancies, and steps) in heterogeneous catalysis. 115 For example, Berdiyorov et al 116 used DFT calculations to investigate the influence of vacancy defects (Ca ions and charge-neutral CO 3 ) on the adsorption properties of CH 4 molecules on the calcite surface. Both types of vacancy defects lead to the strong adsorption of methane molecules compared to defect-free samples.…”

Section: Understanding Of Defects In Catalytic Methane Combustionmentioning

confidence: 99%