Selective adsorption of sulphur dioxide and hydrogen sulphide by metal–organic frameworks

These first principles and grand-canonical Monte Carlo computations show that the adsorption of SO 2 and H 2 S by metal–organic frameworks is efficient and competes with CO 2 and H 2 S inside pores.

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Chimie

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https://hal.science/hal-04414986

Soumis le : mercredi 24 janvier 2024-15:19:19

Dernière modification le : vendredi 16 février 2024-15:14:46

Dates et versions

hal-04414986 , version 1 (24-01-2024)

Identifiants

HAL Id : hal-04414986 , version 1
DOI : 10.1039/d2cp04295a

Citer

S. Grubišić, R. Dahmani, I. Djordjević, M. Sentić, M. Hochlaf. Selective adsorption of sulphur dioxide and hydrogen sulphide by metal–organic frameworks. Physical Chemistry Chemical Physics, 2023, 25 (2), pp.954-965. ⟨10.1039/d2cp04295a⟩. ⟨hal-04414986⟩

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