Bulletin of the American Physical Society
APS March Meeting 2019
Volume 64, Number 2
Monday–Friday, March 4–8, 2019; Boston, Massachusetts
Session 1G: Tutorial 3: Materials by Design: Computational Materials Approach |
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Sponsoring Units: DMP Room: BCEC 152 |
Sunday, March 3, 2019 8:30AM - 12:30PM |
1G.00001: Tutorial 3: Materials by Design: Computational Materials Approach With the advent of density functional theory and the growing power of computer speed and parallel algorithms, a new paradigm in the method used to design materials has emerged. Various properties are calculated for a vast amount of materials through effective workflows. The results allow scientists to populate databases. These are then queried to predict and design novel materials or processes. Using these databases, populating them, and interfacing with them requires a specific training which needs to be fulfilled by the developers or experienced research groups. |
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