Article(id=1319222536248865240, tenantId=1146029695717560320, journalId=1263187385517883426, issueId=1319222524555153701, articleNumber=null, orderNo=null, doi=10.14062/j.issn.0454-5648.20220776, pmid=null, cstr=null, oa=null, hot=null, price=null, onlineType=0, articleFormat=0, articleType=null, articleTypeStr=null, receivedDate=1663689600000, receivedDateStr=2022-09-21, revisedDate=1663948800000, revisedDateStr=2022-09-24, acceptedDate=null, acceptedDateStr=null, onlineDate=1792456762611, onlineDateStr=2026-10-20, pubDate=1676822400000, pubDateStr=2023-02-20, doiRegisterDate=null, doiRegisterDateStr=null, onlineIssueDate=1792456762611, onlineIssueDateStr=2026-10-20, onlineJustAcceptDate=null, onlineJustAcceptDateStr=null, onlineFirstDate=null, onlineFirstDateStr=null, sourceXml=null, magXml=null, createTime=1792456762611, creator=13701087609, updateTime=1792456762611, updator=13701087609, issue=Issue{id=1319222524555153701, tenantId=1146029695717560320, journalId=1263187385517883426, year='2023', volume='51', issue='2', pageStart='283', pageEnd='560', issueExtLink='null', onlineDate='null', pubDate='1676822400000', pubDateStr='2023-02-20', beforeIssueId=null, nextIssueId=null, price=null, status=1, issueComplete=1, articleOrder=1, issueType=-1, specialIssue=0, createTime=1792456759823, creator='13701087609', updateTime=1792456885477, updator='13701087609', preIssue=null, nextIssue=null, articleTotal=null, ext={EN=IssueExt(id=1319223051636560419, tenantId=1146029695717560320, journalId=1263187385517883426, issueId=1319222524555153701, language=EN, specialIssueTitle=, coverIllustrator=null, specialIssueEditor=, specialIssueAbout=), CN=IssueExt(id=1319223051636560420, tenantId=1146029695717560320, journalId=1263187385517883426, issueId=1319222524555153701, language=CN, specialIssueTitle=, coverIllustrator=null, specialIssueEditor=, specialIssueAbout=)}, issueFiles=null, downloadFileDto=null}, startPage=452, endPage=468, ext={EN=ArticleExt(id=1319222538048221657, articleId=1319222536248865240, tenantId=1146029695717560320, journalId=1263187385517883426, language=EN, title=Studies on Perovskite Material and Its Applications via Machine Learning, columnId=1321891389164597932, journalTitle=Journal of the Chinese Ceramic Society, columnName=Application of Machine Learning in Material Research & Development—Review, runingTitle=null, highlight=null, articleAbstract=

The methods of machine learning based on the data science can deal with the corresponding studies in different disciplines based on the data accumulated in theory and experiments. Machine learning promotes the development of data-intensive scientific discoveries, thus making it a "fourth paradigm" that leads to the related scientific research after "theory, calculation, and experimentation". Among different materials, perovskite material has some unique advantages of rich composition, adjustable band gap, and broad development space, but this material does not reach the practical standards such as environmental friendliness in applications. Therefore, the exploration of perovskite material and its applications based on machine learning can accelerate the discovery of novel perovskite material, and explore the relationship between the physical and chemical characteristics of perovskite material, therefore providing a guidance for the development of environmentally friendly high-performance perovskite devices. This review represented the research process of machine learning for perovskite material, summarized some research work on machine learning in perovskite material properties and device exploration, and discussed the existing difficulties and challenges. In addition, the future development direction and trend were also prospected.

, authors=Yang HU1, Shengli ZHANG1, Wenhan ZHOU1, Gaoyu LIU1, Lili XU1, Wanjian YIN2, Haibo ZENG1, authorsList=Yang HU, Shengli ZHANG, Wenhan ZHOU, Gaoyu LIU, Lili XU, Wanjian YIN, Haibo ZENG, authorCompany=null, correspAuthors=Shengli ZHANG, Haibo ZENG, authorNote=

HU Yang (1996-), female, Doctoral candidate. E-mail:

, correspAuthorsNote=
ZENG Haibo (1977-), male, Ph.D., Professor; E-mail:
ZHANG Shengli (1984-), male, Ph.D., Professor.
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经过大半个世纪的算法模型积累,以数据科学为基础的机器学习方法,已经可以适配多项学科的研究需求。在理论与实验积累的数据基础上,机器学习紧跟各个领域的研究潮流,推动数据密集型科学研究的发展,使其成为继“理论”、“计算”、“实验”后引领科学研究的“第四范式”。在材料科学领域,钙钛矿材料具有构成丰富、带隙可调、发展空间广阔等优势,但还未在其适用领域内达到环境友好等实用标准。因而基于机器学习探索钙钛矿材料及其应用,不仅可以加速新型钙钛矿材料的发现,而且可以探究钙钛矿材料种种优异性能与其物理化学特征之间的关联,为发展环境友好型高性能钙钛矿器件提供指导。在此总结了机器学习结合钙钛矿材料的研究优势与研究流程,综述了机器学习在钙钛矿材料性质与器件探索方面的研究进展,探讨了当下面临的研究困境和挑战,展望了未来的研究方向和发展趋势。

, authors=胡扬1, 张胜利1, 周文瀚1, 刘高豫1, 徐丽丽1, 尹万健2, 曾海波1, authorsList=胡扬, 张胜利, 周文瀚, 刘高豫, 徐丽丽, 尹万健, 曾海波, authorCompany=null, correspAuthors=张胜利, 曾海波, authorNote=

胡扬(1996—),女,博士研究生。

, correspAuthorsNote=
曾海波(1977—),男,博士,教授;
张胜利(1984—),男,博士,教授。
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基于机器学习探索钙钛矿材料及其应用
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胡扬 1 , 张胜利 1 , 周文瀚 1 , 刘高豫 1 , 徐丽丽 1 , 尹万健 2 , 曾海波 1
硅酸盐学报 | 机器学习在材料研发中的应用专题—综合评述 2023,51(2): 452-468
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硅酸盐学报 |机器学习在材料研发中的应用专题—综合评述 2023 , 51 (2) : 452 -468
基于机器学习探索钙钛矿材料及其应用
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胡扬1 , 张胜利1 , 周文瀚1, 刘高豫1, 徐丽丽1, 尹万健2, 曾海波1
作者信息
  • 1.南京理工大学材料科学与工程学院,南京 210094
  • 2.苏州大学能源与材料创新研究院,江苏 苏州 215006
通讯作者:
曾海波(1977—),男,博士,教授;
张胜利(1984—),男,博士,教授。
作者简介:

胡扬(1996—),女,博士研究生。

Studies on Perovskite Material and Its Applications via Machine Learning
Yang HU1 , Shengli ZHANG1 , Wenhan ZHOU1, Gaoyu LIU1, Lili XU1, Wanjian YIN2, Haibo ZENG1
Affiliations
  • 1.School of Materials Science and Engineering, Nanjing University of Science and Technology, Nanjing 210094, China
  • 2.Soochow Inst Energy & Mat Innovat SIEMIS, Soochow University, Suzhou 215006, Jiangsu, China
  • Corresponding Author:
    ZENG Haibo (1977-), male, Ph.D., Professor; E-mail:
    ZHANG Shengli (1984-), male, Ph.D., Professor.

    HU Yang (1996-), female, Doctoral candidate. E-mail:

出版时间: 2023-02-20 doi: 10.14062/j.issn.0454-5648.20220776
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经过大半个世纪的算法模型积累,以数据科学为基础的机器学习方法,已经可以适配多项学科的研究需求。在理论与实验积累的数据基础上,机器学习紧跟各个领域的研究潮流,推动数据密集型科学研究的发展,使其成为继“理论”、“计算”、“实验”后引领科学研究的“第四范式”。在材料科学领域,钙钛矿材料具有构成丰富、带隙可调、发展空间广阔等优势,但还未在其适用领域内达到环境友好等实用标准。因而基于机器学习探索钙钛矿材料及其应用,不仅可以加速新型钙钛矿材料的发现,而且可以探究钙钛矿材料种种优异性能与其物理化学特征之间的关联,为发展环境友好型高性能钙钛矿器件提供指导。在此总结了机器学习结合钙钛矿材料的研究优势与研究流程,综述了机器学习在钙钛矿材料性质与器件探索方面的研究进展,探讨了当下面临的研究困境和挑战,展望了未来的研究方向和发展趋势。

钙钛矿材料  /  机器学习  /  材料物性  /  光电器件

The methods of machine learning based on the data science can deal with the corresponding studies in different disciplines based on the data accumulated in theory and experiments. Machine learning promotes the development of data-intensive scientific discoveries, thus making it a "fourth paradigm" that leads to the related scientific research after "theory, calculation, and experimentation". Among different materials, perovskite material has some unique advantages of rich composition, adjustable band gap, and broad development space, but this material does not reach the practical standards such as environmental friendliness in applications. Therefore, the exploration of perovskite material and its applications based on machine learning can accelerate the discovery of novel perovskite material, and explore the relationship between the physical and chemical characteristics of perovskite material, therefore providing a guidance for the development of environmentally friendly high-performance perovskite devices. This review represented the research process of machine learning for perovskite material, summarized some research work on machine learning in perovskite material properties and device exploration, and discussed the existing difficulties and challenges. In addition, the future development direction and trend were also prospected.

perovskite materials  /  machine learning  /  material properties  /  photoelectric device
胡扬, 张胜利, 周文瀚, 刘高豫, 徐丽丽, 尹万健, 曾海波. 基于机器学习探索钙钛矿材料及其应用. 硅酸盐学报, 2023 , 51 (2) : 452 -468 . DOI: 10.14062/j.issn.0454-5648.20220776
Yang HU, Shengli ZHANG, Wenhan ZHOU, Gaoyu LIU, Lili XU, Wanjian YIN, Haibo ZENG. Studies on Perovskite Material and Its Applications via Machine Learning[J]. Journal of the Chinese Ceramic Society, 2023 , 51 (2) : 452 -468 . DOI: 10.14062/j.issn.0454-5648.20220776
  • 国家自然科学基金委员会重大研究计划-培育项目(91964103)
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2023年第51卷第2期
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doi: 10.14062/j.issn.0454-5648.20220776
  • 接收时间:2022-09-21
  • 首发时间:2026-10-20
  • 出版时间:2023-02-20
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  • 收稿日期:2022-09-21
  • 修回日期:2022-09-24
基金
国家自然科学基金委员会重大研究计划-培育项目(91964103)
作者信息
    1.南京理工大学材料科学与工程学院,南京 210094
    2.苏州大学能源与材料创新研究院,江苏 苏州 215006

通讯作者:

曾海波(1977—),男,博士,教授;
张胜利(1984—),男,博士,教授。
参考文献
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https://castjournals.cast.org.cn/joweb/gsyxb/CN/10.14062/j.issn.0454-5648.20220776
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2种不同金属材料的力学参数
科
Family
属数
Number of
genus
种数
Number of
species
占总种数比例
Percentage of
total species (%)
属
Genus
种数
Number of
species
占总种数比例
Percentage of total
species (%)
鹅膏菌科Amanitaceae 2 11 5.26 鹅膏菌属 Amanita 10 4.78
小菇科 Mycenaceae 2 12 5.74 丝盖伞属 Inocybe 5 2.39
多孔菌科 Polyporaceae 8 14 6.70 蜡蘑属 Laccaria 5 2.39
红菇科 Russulaceae 3 23 11.00 小皮伞属 Marasmius 6 2.87
小菇属 Mycena 11 5.26
光柄菇属 Pluteus 5 2.39
红菇属 Russula 17 8.13
栓菌属 Trametes 5 2.39
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