High-throughput Simulations of Metal Organic Frameworks (MOFs) for CO2 Capture

Oktavian, Rama ORCID: https://orcid.org/0000-0003-0701-4213 (2024) High-throughput Simulations of Metal Organic Frameworks (MOFs) for CO2 Capture. PhD thesis, University of Sheffield.

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Supervisors: Moghadam, Peyman Z. and Cordiner, Joan
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Keywords: Metal Organic Frameworks; High-throughput screening; CO2 capture; Grand canonical Monte Carlo (GCMC); CALF-20; Structural flexibility
Awarding institution: University of Sheffield
Academic Units: The University of Sheffield > Faculty of Engineering (Sheffield) > Chemical and Biological Engineering (Sheffield)
Date Deposited: 30 Sep 2024 11:01
Last Modified: 30 Sep 2025 00:05
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