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进入21世纪以来,依赖于科学直觉与试错的传统材料研究方法,已严重滞后于当今技术快速发展的需求。革新材料研发方法,加速材料从研究到应用的转化进程,成为各国材料研究的最新发展战略。2011年6月24日,美国总统奥巴马宣布了一项超过5亿美元的“先进制造业伙伴关系”计划,而“材料基因组计划”是其重要的组成部分之一“。材料基因组计划”是通过高通量的跨尺度材料计算,结合大量可靠的实验数据,用理论模拟去尝试尽可能多的真实或未知材料,建立其化学组分、晶体和各种物性的数据库,并利用信息学、统计学方法,通过数据挖掘探寻材料结构和性能之间的关系模式,为材料设计
Since the beginning of the 21st century, traditional materials research methods relying on scientific intuition and trial and error have lagged far behind the rapid development of technology today. Innovative materials research and development methods to accelerate the material from the research to the application of the transformation process, a national materials research the latest development strategy. On June 24, 2011, US President Barack Obama announced a “Advanced Manufacturing Partnership” program of more than 500 million U.S. dollars, and “Material Genome Project” is one of its major components. “Materials Genome Project ”is a high-throughput cross-scale material calculation, combining a large number of reliable experimental data, using theoretical simulation to try as many real or unknown materials, to establish a database of its chemical composition, crystal and various physical properties, And use information science, statistical methods, through data mining to explore the relationship between material structure and performance of the model for the material design