Mapping the correlations between bandgap, HOMO, and LUMO trends for meta substituted Zn-MOFs

Mapping the correlations between bandgap, HOMO, and LUMO trends for meta substituted Zn-MOFs

© 2024 The Authors. Journal of Computational Chemistry published by Wiley Periodicals LLC.

Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 45(2024), 25 vom: 30. Sept., Seite 2119-2127
Auteur principal: Williamson, Kyle I (Auteur)
Autres auteurs: Herr, Daniel J C, Mo, Yirong
Format: Article en ligne
Langue:English
Publié: 2024
Accès à la collection:Journal of computational chemistry
Sujets:Journal Article bandgap modulation metal–organic framework (MOF) statistical trend analysis substituent effect
Accès en ligne Volltext