在文学中通过数据挖掘自动构建的介电陶数据库
Xiaochao Wang1, Wanli Zhang1, Wenxu Zhang1
1School of Integrated Circuits Science and Engineering, University of Electronic Science and Technology of China, Chengdu 610054, P.R. China.
Journal of chemical information and modeling
|July 23, 2024
概括
研究人员使用自然语言处理 (NLP) 开发了一个数据挖掘管道,从超过12,900件物品中提取介电陶的特性. 这种方法有助于预测材料属性并发现结构与属性关系.
科学领域:
- 材料科学 材料科学 材料科学
- 数据科学数据科学数据科学
- 计算化学计算化学
背景情况:
- 介电陶文献广泛,为大数据分析提供了潜力.
- 识别结构属性关系和预测材料属性对于材料开发至关重要.
研究的目的:
- 构建一个数据挖掘管道,从已发表的文献中提取介电陶特性.
- 为了使20多种材料属性正常化,并分析它们随时间的变化趋势.
- 预测介电性质并确定关键影响因素.
主要方法:
- 自然语言处理 (NLP) 管道用于从12900篇文章中提取信息.
- 对20多种介电陶属性的规范化.
- 训练一个XGBoost模型用于介电常数预测.
- 使用SHAP进行特征重要性分析.
主要成果:
- 在NLP任务中获得了高的微型F1分数 (句子分类为91.6%,命名实体识别为82.4%).
- 经过出版的几年,证明了房地产分配趋势.
- XGBoost模型成功预测了介电常数,其中Q × f被确定为准确性的关键因素.
结论:
- 基于NLP的数据挖掘管道有效提取和规范介电陶特性.
- 这种方法有助于发现结构与财产之间的关系,并有助于财产预测.
- 这些发现为试验人员提供了洞察力,旨在提高介电材料性能.
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