Comparative simulation study of methanol production by CO2 hydrogenation with 3A, 4A and 5A zeolites as adsorbents in a PSA reactor

In this work, the performance of 3A, 4A and 5A zeolites in a PSA reactor to obtain methanol by CO2 hydrogenation has been compared by numerical simulation. Henry's constants of adsorption and the reciprocal diffusion time constants of water and methanol in these adsorbents have been measured in...

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Detalhes bibliográficos
Autores: Delgado Dobladez, José Antonio, Águeda Maté, Vicente Ismael, Álvarez Torrellas, Silvia, Larriba Martínez, Marcos, Pascual Muñoz, Gonzalo, Alberola Sánchez, Raúl
Formato: artículo
Fecha de publicación:2021
País:España
Recursos:Universidad Complutense de Madrid (UCM)
Repositorio:Docta Complutense
Idioma:inglés
OAI Identifier:oai:docta.ucm.es:20.500.14352/125612
Acesso em linha:https://hdl.handle.net/20.500.14352/125612
Access Level:acceso embargado
Palavra-chave:66
Methanol
Carbon dioxide utilization
Hydrogenation
3A zeolite
4A zeolite
5A zeolite
Ingeniería química
3303 Ingeniería y Tecnología Químicas
Descrição
Resumo:In this work, the performance of 3A, 4A and 5A zeolites in a PSA reactor to obtain methanol by CO2 hydrogenation has been compared by numerical simulation. Henry's constants of adsorption and the reciprocal diffusion time constants of water and methanol in these adsorbents have been measured in the reaction temperature range (200–350 °C) to simulate their performance using a zeolite/Cu-ZnO-Al2O3 catalyst mixture. A new cycle has been proposed for PSA reactors including a complete recirculation of heavy product, without using a purge. The best performance is obtained with 3A zeolite, having the lower water and methanol affinities facilitating bed regeneration. With the proposed process, methanol can be produced from CO2 hydrogenation at 250 °C and 50 bar with a conversion of 99.6% in one step, a selectivity of 83–96%, and productivities of 0.023–0.13 mol m3 s−1. The process has minimal loss of H2 in the form of water (1 mol H2O/mole converted CO2).