Bulletin of the American Physical Society
APS March Meeting 2018
Volume 63, Number 1
Monday–Friday, March 5–9, 2018; Los Angeles, California
Session E44: Design of Correlated Electron Materials
8:00 AM–10:48 AM,
Tuesday, March 6, 2018
LACC
Room: 504
Sponsoring
Unit:
DCMP
Chair: Theo Siegrist, NHMFL-FSU
Abstract ID: BAPS.2018.MAR.E44.1
Abstract: E44.00001 : Correlated Materials Design: Prospects and Challenges
8:00 AM–8:12 AM
Presenter:
Ran Adler
(Department of Physics and Astronomy, Rutgers University)
Authors:
Ran Adler
(Department of Physics and Astronomy, Rutgers University)
Chang-Jong Kang
(Department of Physics and Astronomy, Rutgers University)
chuck yee
(Department of Physics and Astronomy, Rutgers University)
Gabriel Kotliar
(Condensed Matter Physics and Materials Science Department, Brookhaven National Lab)
maturing, high throughput framework of DFT-based materials design with the
rapidly-developing first-principles theory for correlated electron systems.
We review the physics of correlations, and propose strategies to capture
their effects at each stage of the materials design workflow. We illustrate
the workflow via examples in several materials classes, encompassing
superconductors, charge ordering and Mott insulators, highlighting the
interplay between theory and experiment and with a view towards finding new
materials.
To cite this abstract, use the following reference: http://meetings.aps.org/link/BAPS.2018.MAR.E44.1
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