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. Database Statistics 144,595 INORGANIC COMPOUNDS 76,240 BANDSTRUCTURES 63,876 MOLECULES 530,243 NANOPOROUS MATERIALS 14,072 ELASTIC TENSORS 3,402 PIEZOELECTRIC TENSORS 4,730 INTERCALATION ELECTRODES 16,128 CONVERSION ELECTRODES
Jain, Anubhav, Shyue Ping Ong, Geoffroy Hautier, Wei Chen, William Davidson Richards, Stephen Dacek, Shreyas Cholia et al. "Commentary: The Materials Project: A materials genome approach to accelerating materials innovation." APL materials 1, no. 1 (2013): 011002.
inorganic materials, materials properties, band structures, molecular, elastic tensor, piezoelectric tensors, electrode,
Curator: hujianju@gmail.com