Understanding the deformation of IRMOF-1 during carbon dioxide and argon adsorption from hybrid Monte Carlo/molecular dynamics simulations

Research Square 2026 Preprint Open access

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Authors: Lucas J. dos Santos, Iuri Soter Viana Segtovich, Amaro Gomes Barreto, Frederico W. Tavares

DOI: 10.21203/rs.3.rs-8492529/v1

Cited by: 0

Fields of Study & Subjects

Metal-Organic Frameworks: Synthesis and Applications Phase Equilibria and Thermodynamics Zeolite Catalysis and Synthesis