Preprint Data Descriptor Version 1 Preserved in Portico This version is not peer-reviewed

Curated Polyoxometalate Formula Dataset

Version 1 : Received: 29 August 2024 / Approved: 30 August 2024 / Online: 2 September 2024 (10:56:59 CEST)

How to cite: Kondinski, A.; Gumerova, N.; Rompel, A. Curated Polyoxometalate Formula Dataset. Preprints 2024, 2024082238. https://doi.org/10.20944/preprints202408.2238.v1 Kondinski, A.; Gumerova, N.; Rompel, A. Curated Polyoxometalate Formula Dataset. Preprints 2024, 2024082238. https://doi.org/10.20944/preprints202408.2238.v1

Abstract

Reticular and cluster materials often feature complex formulas, making a comprehensive overview challenging due to the need to consult various resources. While datasets have been collected for metal-organic frameworks (MOFs), covalent organic frameworks (COFs), and zeolites, among others, there remains a gap in systematically organized information for polyoxometalates. This paper introduces a carefully curated dataset of 1984 polyoxometalate (POM) and related cluster metal oxide formula instances, currently connecting over 2,500 POM material instances. These POM instances incorporate 75 different chemical elements, with compositions ranging from binary to octonary element clusters. This dataset not only enhances accessibility to polyoxometalate data but also aims to facilitate further research and development in the study of these complex inorganic compounds.

Keywords

polyoxometalates; chemical formula; dataset

Subject

Chemistry and Materials Science, Other

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