新型钙钛矿型压电陶瓷的数据挖掘驱动设计

Jian Yu, Jun Yu Li, Yinglong Jiang, J. Chu
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引用次数: 1

摘要

“材料基因组计划”(Materials Genome Initiative)正在设想以两倍的速度和一小部分成本发现、开发、制造和部署先进材料。高通量计算和实验将产生大数据,这强调了第四种范式数据科学的出现。与需要大数据的机器学习不同,由领域知识和专业知识辅助的数据挖掘可以很好地处理有限数量的数据。本文在钙钛矿型氧化物领域进行了基于材料基因组方法的数据挖掘。基于BiFeO3的新型铁电陶瓷实现了高温压电应用,其压电响应是目前商用非钙钛矿同类产品的1.5~4.0倍。我们的论文展示了数据挖掘驱动的搜索确实能够减少洞察时间和人工合成的工作量,加速新材料的发现和部署。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Data-Mining Driven Design for Novel Perovskite-type Piezoceramics
Materials Genome Initiative is envisioning the discovery, development, manufacturing and deployment of advanced materials twice as fast and at a fraction of cost. High throughput computation and experimentation will generate big data, which underscores the emergence of the fourth paradigm data science. In contrast to machine-learning needing big-data, data-mining assisted by domain knowledge and expertise works well with a limited number of data. In this presentation, data-mining based on material genome approach were performed in field of perovskite-type oxides. New ferroelectric ceramics based on BiFeO3 for high temperature piezoelectric applications are realized with piezoresponse of 1.5~4.0 times the present commercial non-perovskite counterpart. Our essay demonstrates data-mining driven searching sure able to reduce time-to-insight and human effort on synthesization, accelerating new materials discovery and deployment.
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