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Structure of Metal-Organic Framework Glasses by Ab Initio Molecular Dynamics

Home / Structure of Metal-Organic Framework Glasses by Ab Initio Molecular Dynamics

R. Gaillac, P. Pullumbi, T. D. Bennett, and F. X. Coudert

DOI: 10.1021/acs.chemmater.0c02950 Chem. Mater. 32, 18, 8004–8011 (2020)

Resource type:

• CP2K

https://pubs.acs.org/doi/10.1021/acs.chemmater.0c02950