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Computational Exploration of Adsorption-Based Hydrogen Storage in Mg-Alkoxide Functionalized Covalent-Organic Frameworks (COFs): Force-Field and Machine Learning Models.

Authors :
Chen, Yu
Zhao, Guobin
Yoon, Sunghyun
Habibi, Parsa
Hong, Chang Seop
Li, Song
Moultos, Othonas A.
Dey, Poulumi
Vlugt, Thijs J. H.
Chung, Yongchul G.
Source :
ACS Applied Materials & Interfaces; 11/13/2024, Vol. 16 Issue 45, p61995-62009, 15p
Publication Year :
2024

Details

Language :
English
ISSN :
19448244
Volume :
16
Issue :
45
Database :
Supplemental Index
Journal :
ACS Applied Materials & Interfaces
Publication Type :
Academic Journal
Accession number :
180891842
Full Text :
https://doi.org/10.1021/acsami.4c11953