Commentary: The Materials Project: A materials genome approach to accelerating materials innovation

APL Materials - Tập 1 Số 1 - 2013
Anubhav Jain1,2, Shyue Ping Ong3,4, Geoffroy Hautier3,1,5, Wei Chen1,2, W. Lance Richards3,4, Stephen Dacek3,4, Shreyas Cholia1,2, Dan Gunter1,2, David Skinner1,2, Gerbrand Ceder3,4, Kristin A. Persson1,2
12Massachusetts Institute of Technology, Cambridge 02139, Massachusetts, USA
2Lawrence Berkeley National Laboratory 1 , Berkeley 94720, California, USA
31Lawrence Berkeley National Laboratory, Berkeley 94720, California, USA
4Massachusetts Institute of Technology 2 , Cambridge 02139, Massachusetts, USA
5Université catholique de Louvain 3 , Louvain-la-Neuve, Belgium

Tóm tắt

Accelerating the discovery of advanced materials is essential for human welfare and sustainable, clean energy. In this paper, we introduce the Materials Project (www.materialsproject.org), a core program of the Materials Genome Initiative that uses high-throughput computing to uncover the properties of all known inorganic materials. This open dataset can be accessed through multiple channels for both interactive exploration and data mining. The Materials Project also seeks to create open-source platforms for developing robust, sophisticated materials analyses. Future efforts will enable users to perform ‘‘rapid-prototyping’’ of new materials in silico, and provide researchers with new avenues for cost-effective, data-driven materials design.

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