材料创新的未来愿景以及如何利用服务快速实现创新

Lorenz J. Falling*, 
{"title":"材料创新的未来愿景以及如何利用服务快速实现创新","authors":"Lorenz J. Falling*,&nbsp;","doi":"10.1021/acsphyschemau.4c0000910.1021/acsphyschemau.4c00009","DOIUrl":null,"url":null,"abstract":"<p >Today, we witness how our scientific ecosystem tries to accommodate a new form of intelligence, artificial intelligence (AI). To make the most of AI in materials science, we need to make the data from computational and laboratory experiments machine-readable, but while that works well for computational experiments, integrating laboratory hardware into a digital workflow seems to be a formidable barrier toward that goal. This paper explores measurement services as a way to lower this barrier. I envision the Entity for Multivariate Material Analysis (EMMA), a centralized service that offers measurement bundles tailored for common research needs. EMMA’s true strength, however, lies in its software ecosystem to treat, simulate, and store the measured data. Its close integration of measurements and their simulation not only produces metadata-rich experimental data but also provides a self-consistent framework that links the sample with a snapshot of its digital twin. If EMMA was to materialize, its database of experimental data connected to digital twins could serve as the fuel for physics-informed machine learning and a trustworthy horizon of expectations for material properties. This drives material innovation since knowing the statistics helps find the exceptional. This is the EMMA approach: fast-tracking material innovation by integrated measurement and software services.</p>","PeriodicalId":29796,"journal":{"name":"ACS Physical Chemistry Au","volume":"4 5","pages":"420–429 420–429"},"PeriodicalIF":3.7000,"publicationDate":"2024-06-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/epdf/10.1021/acsphyschemau.4c00009","citationCount":"0","resultStr":"{\"title\":\"A Vision for the Future of Materials Innovation and How to Fast-Track It with Services\",\"authors\":\"Lorenz J. Falling*,&nbsp;\",\"doi\":\"10.1021/acsphyschemau.4c0000910.1021/acsphyschemau.4c00009\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p >Today, we witness how our scientific ecosystem tries to accommodate a new form of intelligence, artificial intelligence (AI). To make the most of AI in materials science, we need to make the data from computational and laboratory experiments machine-readable, but while that works well for computational experiments, integrating laboratory hardware into a digital workflow seems to be a formidable barrier toward that goal. This paper explores measurement services as a way to lower this barrier. I envision the Entity for Multivariate Material Analysis (EMMA), a centralized service that offers measurement bundles tailored for common research needs. EMMA’s true strength, however, lies in its software ecosystem to treat, simulate, and store the measured data. Its close integration of measurements and their simulation not only produces metadata-rich experimental data but also provides a self-consistent framework that links the sample with a snapshot of its digital twin. If EMMA was to materialize, its database of experimental data connected to digital twins could serve as the fuel for physics-informed machine learning and a trustworthy horizon of expectations for material properties. This drives material innovation since knowing the statistics helps find the exceptional. This is the EMMA approach: fast-tracking material innovation by integrated measurement and software services.</p>\",\"PeriodicalId\":29796,\"journal\":{\"name\":\"ACS Physical Chemistry Au\",\"volume\":\"4 5\",\"pages\":\"420–429 420–429\"},\"PeriodicalIF\":3.7000,\"publicationDate\":\"2024-06-12\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://pubs.acs.org/doi/epdf/10.1021/acsphyschemau.4c00009\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"ACS Physical Chemistry Au\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://pubs.acs.org/doi/10.1021/acsphyschemau.4c00009\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, PHYSICAL\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"ACS Physical Chemistry Au","FirstCategoryId":"1085","ListUrlMain":"https://pubs.acs.org/doi/10.1021/acsphyschemau.4c00009","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0

摘要

今天,我们目睹了科学生态系统如何努力适应一种新的智能形式--人工智能(AI)。要在材料科学领域充分利用人工智能,我们需要让计算实验和实验室实验的数据具有机器可读性,虽然这对计算实验很有效,但将实验室硬件集成到数字工作流程中似乎是实现这一目标的巨大障碍。本文探讨了降低这一障碍的测量服务。我设想的多变量材料分析实体(EMMA)是一种集中式服务,可提供针对常见研究需求量身定制的测量捆绑服务。不过,EMMA 的真正优势在于其处理、模拟和存储测量数据的软件生态系统。它将测量与模拟紧密结合,不仅产生了元数据丰富的实验数据,还提供了一个自洽的框架,将样本与其数字孪生快照联系起来。如果EMMA得以实现,其与数字孪生连接的实验数据数据库将成为以物理学为基础的机器学习的燃料,并为材料特性提供一个值得信赖的预期范围。这将推动材料创新,因为了解统计数据有助于发现非凡之处。这就是 EMMA 方法:通过集成测量和软件服务快速跟踪材料创新。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
查看原文
分享 分享
微信好友 朋友圈 QQ好友 复制链接
本刊更多论文
A Vision for the Future of Materials Innovation and How to Fast-Track It with Services

Today, we witness how our scientific ecosystem tries to accommodate a new form of intelligence, artificial intelligence (AI). To make the most of AI in materials science, we need to make the data from computational and laboratory experiments machine-readable, but while that works well for computational experiments, integrating laboratory hardware into a digital workflow seems to be a formidable barrier toward that goal. This paper explores measurement services as a way to lower this barrier. I envision the Entity for Multivariate Material Analysis (EMMA), a centralized service that offers measurement bundles tailored for common research needs. EMMA’s true strength, however, lies in its software ecosystem to treat, simulate, and store the measured data. Its close integration of measurements and their simulation not only produces metadata-rich experimental data but also provides a self-consistent framework that links the sample with a snapshot of its digital twin. If EMMA was to materialize, its database of experimental data connected to digital twins could serve as the fuel for physics-informed machine learning and a trustworthy horizon of expectations for material properties. This drives material innovation since knowing the statistics helps find the exceptional. This is the EMMA approach: fast-tracking material innovation by integrated measurement and software services.

求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
CiteScore
3.70
自引率
0.00%
发文量
0
期刊介绍: ACS Physical Chemistry Au is an open access journal which publishes original fundamental and applied research on all aspects of physical chemistry. The journal publishes new and original experimental computational and theoretical research of interest to physical chemists biophysical chemists chemical physicists physicists material scientists and engineers. An essential criterion for acceptance is that the manuscript provides new physical insight or develops new tools and methods of general interest. Some major topical areas include:Molecules Clusters and Aerosols; Biophysics Biomaterials Liquids and Soft Matter; Energy Materials and Catalysis
期刊最新文献
Issue Publication Information Issue Editorial Masthead Roundabout Mechanism of Ion–Molecule Nucleophilic Substitution Reactions Ultrafast Spin Relaxation of Charge Carriers in Strongly Quantum Confined Methylammonium Lead Bromide Perovskite Magic-Sized Clusters Direct Detection of Bound Water in Hydrated Powders of Lysozyme by Differential Scanning Calorimetry
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
现在去查看 取消
×
提示
确定
0
微信
客服QQ
Book学术公众号 扫码关注我们
反馈
×
意见反馈
请填写您的意见或建议
请填写您的手机或邮箱
已复制链接
已复制链接
快去分享给好友吧!
我知道了
×
扫码分享
扫码分享
Book学术官方微信
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术
文献互助 智能选刊 最新文献 互助须知 联系我们:info@booksci.cn
Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。
Copyright © 2023 Book学术 All rights reserved.
ghs 京公网安备 11010802042870号 京ICP备2023020795号-1