Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles
Apparent kinetics is often used to describe a variety of reactions in the field of chemical looping and solar thermochemical processes, yet a rigorous analytical methodology for utilizing such kinetics has been lacking. The implementation of a novel approach was exemplified in the ceria thermochemic...
Saved in:
| Main Authors: | , , , |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
MDPI AG
2025-01-01
|
| Series: | Energies |
| Subjects: | |
| Online Access: | https://www.mdpi.com/1996-1073/18/2/414 |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
| _version_ | 1832588574810177536 |
|---|---|
| author | Francesco Orsini Domenico Ferrero Davide Papurello Massimo Santarelli |
| author_facet | Francesco Orsini Domenico Ferrero Davide Papurello Massimo Santarelli |
| author_sort | Francesco Orsini |
| collection | DOAJ |
| description | Apparent kinetics is often used to describe a variety of reactions in the field of chemical looping and solar thermochemical processes, yet a rigorous analytical methodology for utilizing such kinetics has been lacking. The implementation of a novel approach was exemplified in the ceria thermochemical cycle for producing solar thermochemical hydrogen, specifically in the H<sub>2</sub>O-driven oxidation step. The H<sub>2</sub> production rate equation was derived, rearranging apparent kinetics from experimental data in the literature into a more suitable analytical form. The 1D model integrates heat transfer, fluid dynamics, and redox chemistry, providing the description of a directly irradiated solar receiver–reactor. Model robustness is ensured through the oxygen mass balance across the cycle, and the comparison against experimental data shows high agreement. The methodology can be useful for simulating chemical looping cycles using any nonstoichiometric oxide, such as ceria-based oxides and, most importantly, oxidation-limited perovskites, for which optimizing the oxidation step in terms of fluid flow, kinetics, and reaction times is crucial. The proposed analytical model can be applied to arbitrarily complex reactor geometries. The inherently local nature of the model also allows the spatial distributions of the redox material’s conversion and utilization to be obtained, paving the way for optimization strategies of the reactor’s design and operation. |
| format | Article |
| id | doaj-art-b3e120251a7940878acbc51455c15be5 |
| institution | Kabale University |
| issn | 1996-1073 |
| language | English |
| publishDate | 2025-01-01 |
| publisher | MDPI AG |
| record_format | Article |
| series | Energies |
| spelling | doaj-art-b3e120251a7940878acbc51455c15be52025-01-24T13:31:24ZengMDPI AGEnergies1996-10732025-01-0118241410.3390/en18020414Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox CyclesFrancesco Orsini0Domenico Ferrero1Davide Papurello2Massimo Santarelli3Department of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Turin, ItalyDepartment of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Turin, ItalyDepartment of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Turin, ItalyDepartment of Energy, Politecnico di Torino, Corso Duca degli Abruzzi 24, 10129 Turin, ItalyApparent kinetics is often used to describe a variety of reactions in the field of chemical looping and solar thermochemical processes, yet a rigorous analytical methodology for utilizing such kinetics has been lacking. The implementation of a novel approach was exemplified in the ceria thermochemical cycle for producing solar thermochemical hydrogen, specifically in the H<sub>2</sub>O-driven oxidation step. The H<sub>2</sub> production rate equation was derived, rearranging apparent kinetics from experimental data in the literature into a more suitable analytical form. The 1D model integrates heat transfer, fluid dynamics, and redox chemistry, providing the description of a directly irradiated solar receiver–reactor. Model robustness is ensured through the oxygen mass balance across the cycle, and the comparison against experimental data shows high agreement. The methodology can be useful for simulating chemical looping cycles using any nonstoichiometric oxide, such as ceria-based oxides and, most importantly, oxidation-limited perovskites, for which optimizing the oxidation step in terms of fluid flow, kinetics, and reaction times is crucial. The proposed analytical model can be applied to arbitrarily complex reactor geometries. The inherently local nature of the model also allows the spatial distributions of the redox material’s conversion and utilization to be obtained, paving the way for optimization strategies of the reactor’s design and operation.https://www.mdpi.com/1996-1073/18/2/414solar thermochemical hydrogensolar reactornumerical modellingapparent kineticsnonstoichiometric oxygen carrier |
| spellingShingle | Francesco Orsini Domenico Ferrero Davide Papurello Massimo Santarelli Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles Energies solar thermochemical hydrogen solar reactor numerical modelling apparent kinetics nonstoichiometric oxygen carrier |
| title | Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles |
| title_full | Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles |
| title_fullStr | Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles |
| title_full_unstemmed | Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles |
| title_short | Solar Thermochemical Fuel Production: A Novel, Validated Multiphysics Reactor Model for the Reduction–Oxidation of Nonstoichiometric Redox Cycles |
| title_sort | solar thermochemical fuel production a novel validated multiphysics reactor model for the reduction oxidation of nonstoichiometric redox cycles |
| topic | solar thermochemical hydrogen solar reactor numerical modelling apparent kinetics nonstoichiometric oxygen carrier |
| url | https://www.mdpi.com/1996-1073/18/2/414 |
| work_keys_str_mv | AT francescoorsini solarthermochemicalfuelproductionanovelvalidatedmultiphysicsreactormodelforthereductionoxidationofnonstoichiometricredoxcycles AT domenicoferrero solarthermochemicalfuelproductionanovelvalidatedmultiphysicsreactormodelforthereductionoxidationofnonstoichiometricredoxcycles AT davidepapurello solarthermochemicalfuelproductionanovelvalidatedmultiphysicsreactormodelforthereductionoxidationofnonstoichiometricredoxcycles AT massimosantarelli solarthermochemicalfuelproductionanovelvalidatedmultiphysicsreactormodelforthereductionoxidationofnonstoichiometricredoxcycles |