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Minería de Datos Histórica Profundiza en la Investigación de Materiales 2D Asistida por Aprendizaje Automático en
Krittapong Deshsorn1,2, Panwad Chavalekvirat1,2, Somrudee Deepaisarn3,2
1School of Bio-Chemical Engineering and Technology, Sirindhorn International Institute of Technology, Thammasat University, Pathum Thani 12120, Thailand.
El aprendizaje automático acelera el descubrimiento y la optimización de materiales 2D para aplicaciones energéticas. Esta revisión analiza las tendencias y destaca cómo el aprendizaje automático, la teoría de la funcional de la densidad y la experimentación avanzan la ciencia de los materiales.
Área de la Ciencia:
- Materials Science
- Computational Chemistry
- Electrochemistry
Sus antecedentes:
- Machine learning (ML) is revolutionizing 2D materials design.
- ML accelerates discovery, optimization, and screening processes.
- Integration of ML in 2D materials for electrochemical energy applications is a growing field.
Objetivo del estudio:
- To review the historical and ongoing integration of ML in 2D materials for electrochemical energy applications.
- To analyze trends and insights using the Knowledge Discovery in Databases (KDD) approach.
- To highlight the synergy between ML, density functional theory (DFT), and experimentation.
Principales métodos:
- Data mining from the Scopus database.
- Analysis of citations, keywords, and trends.
- Computer analysis of literature reports (heat maps, network graphs) for macro and micro scope insights.
Principales resultados:
- Identified key insights from large-scale literature analysis.
- Showcased ML techniques for identifying critical material properties.
- Demonstrated the joint advancement of materials science through ML, DFT, and experimentation.
Conclusiones:
- ML, DFT, and traditional experimentation are collectively driving progress in 2D materials for energy applications.
- This review provides a comprehensive analysis of ML applications in batteries, fuel cells, supercapacitors, and synthesis.
- ML is crucial for enhancing the identification of essential material properties.
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