Integrated materials design and informatics platform within the materials genome framework

被引:5
作者
Wang, Zhuo [1 ]
Yang, Xiaoyu [2 ]
Zheng, Yufei [3 ]
Yong, Qilong [1 ]
Su, Hang [1 ]
Yang, Caifu [1 ]
机构
[1] Cent Iron & Steel Res Inst, Beijing 100081, Peoples R China
[2] Chinese Acad Sci, Comp Network Informat Ctr, Beijing 100190, Peoples R China
[3] Chinese Acad Sci, Inst Comp Technol, Beijing 100190, Peoples R China
来源
CHINESE SCIENCE BULLETIN | 2014年 / 59卷 / 15期
关键词
Integrated materials design; Materials database; High-throughput materials simulation; Materials informatics; Experimental data management; MatCloud;
D O I
10.1007/s11434-014-0225-6
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
The fundamental idea of materials genome initiative is the integration of computing platform, experimental platform, and data platform to speed up the material innovation hence reduce time and cost. This paper describes the basic concept of building an integrated computational platform and data platform for material innovation from the perspective of high-throughput simulation and materials knowledge management. The material data platform that can integrate material database, heterogeneous material data, various scripts, and open-source material simulation code together is particularly discussed. Taking metallic materials as an example, a brief introduction to metallic materials data management is given, and how to manage the semi-structure and unstructured iron and steel material data is also presented.
引用
收藏
页码:1755 / 1764
页数:10
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