From the computer to the laboratory: materials discovery and design using first-principles calculations

The development of new technological materials has historically been a difficult and time-consuming task. The traditional role of computation in materials design has been to better understand existing materials. However, an emerging paradigm for accelerated materials discovery is to design new compo...

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Bibliographic Details
Main Authors: Hautier, Geoffroy (Author), Jain, Anubhav (Author), Ong, Shyue Ping (Contributor)
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering (Contributor)
Format: Article
Language:English
Published: Springer US, 2016-11-21T19:09:22Z.
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