Thermodynamics of alkali metal ion uptake from aqueous solution in MOF-808
Article 2025 en
Authors
YP
Yuanhui Pan
SS
Suman Saha
MB
Matthew Burigana
Abstract
1 min read
Molecular mechanisms governing alkali metal ion uptake from aqueous solution in MOF-808 are studied via free-energy calculations and enhanced sampling simulations, revealing the subtle interplay between hydration structure and confinement effects.
Hao Lyu, Oscar Iu‐Fan Chen, Nikita Hanikel, Mohammad I. Hossain, Robinson W. Flaig, Xiaokun Pei, Ameer Amin, Mark D. Doherty, Rebekah K. Impastato, T. Grant Glover, David R. Moore, Omar M Yaghi
Hao Lyu, Oscar Iu‐Fan Chen, Nikita Hanikel, Mohammad I. Hossain, Robinson W. Flaig, Xiaokun Pei, Ameer Amin, Mark D. Doherty, Rebekah K. Impastato, T. Grant Glover, David R. Moore, Omar M Yaghi
Discussion(0)
No comments yet. Be the first to comment.