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PreprintCC BYChemRxiv

Beyond Materials Rankings: When Adsorption or Membranes Win for CO2/CH4 Separation

5 affiliations
  1. 1Lucy Cavendish College
  2. 2University of Cambridge
  3. 3University of Auckland
  4. 4School of Chemical Engineering, Faculty of Engineering
  5. 5University of Tehran

Abstract

Choosing between adsorption and membranes for carbon dioxide removal from methane is often reduced to a contest between material metrics, even though an industrially meaningful answer emerges from the coupled material, flowsheet, pressure, composition, recovery, and economic context. Here we compare the technologies on a common process boundary, allowing each to select its process-optimal material, equipment size, and membrane architecture while meeting identical methane-product and recovery constraints. The resulting atlas spans 300 ARC–MOF adsorbents, 220 experimental polymers, and 864 matched biogas-and natural-gas-like scenarios. Among 676 mutually feasible cases, adsorption minimizes annualized cost in 73.4% and membranes in 26.6%; choosing the wrong technology incurs a median cost regret of 19.4%. Crucially, the boundary is not a single pressure threshold. Four pressurized-natural-gas slices exhibit clean adsorption–membrane–adsorption re-entry as the optimal material and membrane flowsheet switch with operating conditions. Material and architecture ablations isolate this mechanism. Cost-based choices disagree with energy, methane-loss, and footprint choices in 30.8–46.0% of paired comparisons, while cost and operational-climate choices disagree in 25.4%; joint uncertainty creates an explicit abstention region in 18.3% of boundary-focused cases. The framework converts high-throughput materials screening into conditional, auditable technology-selection rules and a compact agenda for cycle and mixed-gas validation under realistic process conditions and quantified uncertainty ranges.

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BibTeX
@misc{asgari2026beyond,
  title = {{Beyond Materials Rankings: When Adsorption or Membranes Win for CO2/CH4 Separation}},
  author = {Mehrdad Asgari and Mohammad Sadegh Salimian Rizi and Shayan Abaei and Zeynep Defne Sezen},
  howpublished = {ChemRxiv},
  year = {2026},
  month = oct,
  doi = {10.26434/chemrxiv.15010238/v1},
  url = {https://chemrxiv.org/doi/full/10.26434/chemrxiv.15010238/v1},
  note = {CC BY},
}
RIS
TY  - UNPB
TI  - Beyond Materials Rankings: When Adsorption or Membranes Win for CO2/CH4 Separation
AU  - Mehrdad Asgari
AU  - Mohammad Sadegh Salimian Rizi
AU  - Shayan Abaei
AU  - Zeynep Defne Sezen
PY  - 2026
DA  - 2026/10/11
PB  - ChemRxiv
DO  - 10.26434/chemrxiv.15010238/v1
UR  - https://chemrxiv.org/doi/full/10.26434/chemrxiv.15010238/v1
AB  - Choosing between adsorption and membranes for carbon dioxide removal from methane is often reduced to a contest between material metrics, even though an industrially meaningful answer emerges from the coupled material, flowsheet, pressure, composition, recovery, and economic context. Here we compare the technologies on a common process boundary, allowing each to select its process-optimal material, equipment size, and membrane architecture while meeting identical methane-product and recovery constraints. The resulting atlas spans 300 ARC–MOF adsorbents, 220 experimental polymers, and 864 matched biogas-and natural-gas-like scenarios. Among 676 mutually feasible cases, adsorption minimizes annualized cost in 73.4% and membranes in 26.6%; choosing the wrong technology incurs a median cost regret of 19.4%. Crucially, the boundary is not a single pressure threshold. Four pressurized-natural-gas slices exhibit clean adsorption–membrane–adsorption re-entry as the optimal material and membrane flowsheet switch with operating conditions. Material and architecture ablations isolate this mechanism. Cost-based choices disagree with energy, methane-loss, and footprint choices in 30.8–46.0% of paired comparisons, while cost and operational-climate choices disagree in 25.4%; joint uncertainty creates an explicit abstention region in 18.3% of boundary-focused cases. The framework converts high-throughput materials screening into conditional, auditable technology-selection rules and a compact agenda for cycle and mixed-gas validation under realistic process conditions and quantified uncertainty ranges.
ER  -