Mining Knowledge from Crystal Structures: Oxidation States of Oxygen-Coordinated Metal Atoms in Ionic and Coordination Compounds-Reference-Cited by-同舟云学术

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Mining Knowledge from Crystal Structures: Oxidation States of Oxygen-Coordinated Metal Atoms in Ionic and Coordination Compounds

Published:2022-05-06 Issue:10 Volume:62 Page:2332-2340
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Shevchenko Alexander P.¹²^ORCID,Smolkov Michail I.¹³,Wang Junjie⁴,Blatov Vladislav A.¹⁴^ORCID

Affiliation:

1. SCTMS, Samara State Technical University, Samara 443100, Russian Federation

2. Samara Branch, P.N. Lebedev Physical Institute of the Russian Academy of Sciences, Samara 443011, Russian Federation

3. Povolzhskiy State University of Telecommunications and Informatics, Samara 443010, Russian Federation

4. State Key Laboratory of Solidification Processing, Northwestern Polytechnical University, Xi’an, Shaanxi 710072, People’s Republic of China

Funder

Russian Foundation for Basic Research

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.2c00080

Reference38 articles.

1. A Million Crystal Structures: The Whole Is Greater than the Sum of Its Parts

2. Insightful classification of crystal structures using deep learning

3. Crystal Structure Prediction via Deep Learning

4. Machine Learning Constrained with Dimensional Analysis and Scaling Laws: Simple, Transferable, and Interpretable Models of Materials from Small Datasets

5. Toward a comprehensive definition of oxidation state (IUPAC Technical Report)

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1. Novel heteroligand Ni(II) complexes with benzylmalonate dianions: synthesis, structure, and thermal behavior;Monatshefte für Chemie - Chemical Monthly;2023-08-19

2. Composition Based Oxidation State Prediction of Materials Using Deep Learning Language Models;Advanced Science;2023-08-07

3. cell2mol: encoding chemistry to interpret crystallographic data;npj Computational Materials;2022-08-31

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