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Performance of GFN1-xTB for periodic optimization of Metal Organic Frameworks (2022)

First Author: Nurhuda, M.

Attributed to: Origin and Mechanisms of Flexibility in Molecular Framework Materials: A Data-driven, Graph Theoretical Approach funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Publication URI: https://chemrxiv.org/engage/chemrxiv/article-details/61deaea0e7b75191b297900d

Type: Journal Article/Review

Parent Publication: ChemRXiv