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Feature Selection in Machine Learning for Perovskite Materials Design and Discovery

Perovskite materials have been one of the most important research objects in materials science due to their excellent photoelectric properties as well as correspondingly complex structures. Machine learning (ML) methods have been playing an important role in the design and discovery of perovskite ma...

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Detalles Bibliográficos
Autores principales: Wang, Junya, Xu, Pengcheng, Ji, Xiaobo, Li, Minjie, Lu, Wencong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10146176/
https://www.ncbi.nlm.nih.gov/pubmed/37109971
http://dx.doi.org/10.3390/ma16083134
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author Wang, Junya
Xu, Pengcheng
Ji, Xiaobo
Li, Minjie
Lu, Wencong
author_facet Wang, Junya
Xu, Pengcheng
Ji, Xiaobo
Li, Minjie
Lu, Wencong
author_sort Wang, Junya
collection PubMed
description Perovskite materials have been one of the most important research objects in materials science due to their excellent photoelectric properties as well as correspondingly complex structures. Machine learning (ML) methods have been playing an important role in the design and discovery of perovskite materials, while feature selection as a dimensionality reduction method has occupied a crucial position in the ML workflow. In this review, we introduced the recent advances in the applications of feature selection in perovskite materials. First, the development tendency of publications about ML in perovskite materials was analyzed, and the ML workflow for materials was summarized. Then the commonly used feature selection methods were briefly introduced, and the applications of feature selection in inorganic perovskites, hybrid organic-inorganic perovskites (HOIPs), and double perovskites (DPs) were reviewed. Finally, we put forward some directions for the future development of feature selection in machine learning for perovskite material design.
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spelling pubmed-101461762023-04-29 Feature Selection in Machine Learning for Perovskite Materials Design and Discovery Wang, Junya Xu, Pengcheng Ji, Xiaobo Li, Minjie Lu, Wencong Materials (Basel) Review Perovskite materials have been one of the most important research objects in materials science due to their excellent photoelectric properties as well as correspondingly complex structures. Machine learning (ML) methods have been playing an important role in the design and discovery of perovskite materials, while feature selection as a dimensionality reduction method has occupied a crucial position in the ML workflow. In this review, we introduced the recent advances in the applications of feature selection in perovskite materials. First, the development tendency of publications about ML in perovskite materials was analyzed, and the ML workflow for materials was summarized. Then the commonly used feature selection methods were briefly introduced, and the applications of feature selection in inorganic perovskites, hybrid organic-inorganic perovskites (HOIPs), and double perovskites (DPs) were reviewed. Finally, we put forward some directions for the future development of feature selection in machine learning for perovskite material design. MDPI 2023-04-16 /pmc/articles/PMC10146176/ /pubmed/37109971 http://dx.doi.org/10.3390/ma16083134 Text en © 2023 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Review
Wang, Junya
Xu, Pengcheng
Ji, Xiaobo
Li, Minjie
Lu, Wencong
Feature Selection in Machine Learning for Perovskite Materials Design and Discovery
title Feature Selection in Machine Learning for Perovskite Materials Design and Discovery
title_full Feature Selection in Machine Learning for Perovskite Materials Design and Discovery
title_fullStr Feature Selection in Machine Learning for Perovskite Materials Design and Discovery
title_full_unstemmed Feature Selection in Machine Learning for Perovskite Materials Design and Discovery
title_short Feature Selection in Machine Learning for Perovskite Materials Design and Discovery
title_sort feature selection in machine learning for perovskite materials design and discovery
topic Review
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10146176/
https://www.ncbi.nlm.nih.gov/pubmed/37109971
http://dx.doi.org/10.3390/ma16083134
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