Factors governing the protonation of Keggin-type polyoxometalates: influence of the core structure in clusters

This article is licensed under aCreative Commons Attribution-NonCommercial 3.0 Unported Licence.Hiroshi Sampei, Hiromu Akiyama, Koki Saegusa, Masahiro Yamaguchi, Shuhei Ogo, Hiromi Nakai, Tadaharu Ueda, Yasushi Sekine DFT calculation of Keggin-type polyoxometalates provided the first protonation sites and HOMO-LUMO gaps related to their total charge and bond valence. To cite this article before page numbers are assigned, use the DOI form of citation above. The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - Dalton Trans. latest articles - April 24, 2024 Category: Chemistry Authors: Hiroshi Sampei Source Type: research