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Mono-dimensional and two-dimensional models for chemical looping reforming with packed bed reactors and validation under real process conditions

Mono-dimensional and two-dimensional models for chemical looping reforming with packed bed reactors and validation under real process conditions
Mono-dimensional and two-dimensional models for chemical looping reforming with packed bed reactors and validation under real process conditions
Chemical looping reforming (CLR) is an emerging hydrogen/syngas production technology, integrated with CO2 capture. Packed bed reactors are widely used in the hydrogen production industry as they are preferred for high pressure operation and the mathematical modelling describing their operation is very important for their design. In this study, a one-dimensional (1-D) and a two-dimensional (2-D) model have been developed to describe the dynamic operation of chemical looping reforming processes in packed bed reactors (CLR-PB). The reactor under study (L: 400 mm ID: 35 mm) contains an axially placed thermowell (OD: 6.35 mm) to monitor the temperature across the reactor bed at 6 points and 440 g of NiO/CaAl2O4 oxygen carrier (OC). Both models have been validated presenting very good agreement with the experimental results. The comparison between modelling and experimental results has been carried out in terms of thermowell temperature and the gas composition breakthroughs, with the 2-D model capturing the thermowell temperature recordings with high accuracy, while the 1-D model delivered results that underestimated it by 2.5%. Nonetheless, the predicted average bed temperature presented a difference limited to 1% lower estimation of the 1-D to the 2-D model. The temperature difference between the bed and the thermowell has achieved a value of >180 °C thus resulting also problematic in terms of safe operation if not properly considered. with temperatures during oxidation being higher even by 181 °C inside the bed, emphasizing the importance of the model in the proper design and safe operation of the reactor. The 1-D model, due to the significantly lower computation time (∼21 times faster than 2-D), has been selected to be tested against a range of operating conditions for oxidation (500–600 °C, 1–5 bar, 10–40 NLPM, 10–20% O2), reduction (600–900 °C, 1–5 bar) with H2, syngas and CH4-rich reducing agents and dry reforming (700–900 °C, 1–5 bar), delivering results with good agreement especially under high temperature conditions where solid conversion is high and under conditions which resemble the expected industrial ones.
2755
Argyris, Panagiotis Alexandros
b208e164-858d-4215-8afb-302b9baf6b0b
de Leeuwe, Christopher
03e581bf-8436-4287-a9c0-9773c00cd541
Abbas, Syed Zaheer
3b02900e-fef6-40e1-acf7-96f26bfde4a8
Spallina, Vincenzo
e87fad8c-a44b-48a6-9da6-f60de3ce87a5
Argyris, Panagiotis Alexandros
b208e164-858d-4215-8afb-302b9baf6b0b
de Leeuwe, Christopher
03e581bf-8436-4287-a9c0-9773c00cd541
Abbas, Syed Zaheer
3b02900e-fef6-40e1-acf7-96f26bfde4a8
Spallina, Vincenzo
e87fad8c-a44b-48a6-9da6-f60de3ce87a5

Argyris, Panagiotis Alexandros, de Leeuwe, Christopher, Abbas, Syed Zaheer and Spallina, Vincenzo (2022) Mono-dimensional and two-dimensional models for chemical looping reforming with packed bed reactors and validation under real process conditions. Sustainable Energy & Fuels, 2755. (doi:10.1039/D2SE00351A).

Record type: Article

Abstract

Chemical looping reforming (CLR) is an emerging hydrogen/syngas production technology, integrated with CO2 capture. Packed bed reactors are widely used in the hydrogen production industry as they are preferred for high pressure operation and the mathematical modelling describing their operation is very important for their design. In this study, a one-dimensional (1-D) and a two-dimensional (2-D) model have been developed to describe the dynamic operation of chemical looping reforming processes in packed bed reactors (CLR-PB). The reactor under study (L: 400 mm ID: 35 mm) contains an axially placed thermowell (OD: 6.35 mm) to monitor the temperature across the reactor bed at 6 points and 440 g of NiO/CaAl2O4 oxygen carrier (OC). Both models have been validated presenting very good agreement with the experimental results. The comparison between modelling and experimental results has been carried out in terms of thermowell temperature and the gas composition breakthroughs, with the 2-D model capturing the thermowell temperature recordings with high accuracy, while the 1-D model delivered results that underestimated it by 2.5%. Nonetheless, the predicted average bed temperature presented a difference limited to 1% lower estimation of the 1-D to the 2-D model. The temperature difference between the bed and the thermowell has achieved a value of >180 °C thus resulting also problematic in terms of safe operation if not properly considered. with temperatures during oxidation being higher even by 181 °C inside the bed, emphasizing the importance of the model in the proper design and safe operation of the reactor. The 1-D model, due to the significantly lower computation time (∼21 times faster than 2-D), has been selected to be tested against a range of operating conditions for oxidation (500–600 °C, 1–5 bar, 10–40 NLPM, 10–20% O2), reduction (600–900 °C, 1–5 bar) with H2, syngas and CH4-rich reducing agents and dry reforming (700–900 °C, 1–5 bar), delivering results with good agreement especially under high temperature conditions where solid conversion is high and under conditions which resemble the expected industrial ones.

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Accepted/In Press date: 17 April 2022
Published date: 20 April 2022

Identifiers

Local EPrints ID: 474503
URI: http://eprints.soton.ac.uk/id/eprint/474503
PURE UUID: b51ee34f-de06-408c-83ab-1118ac0f9055
ORCID for Syed Zaheer Abbas: ORCID iD orcid.org/0000-0002-8783-8572

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Date deposited: 23 Feb 2023 17:39
Last modified: 17 Mar 2024 04:18

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Contributors

Author: Panagiotis Alexandros Argyris
Author: Christopher de Leeuwe
Author: Syed Zaheer Abbas ORCID iD
Author: Vincenzo Spallina

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