Research Update: Towards designed functionalities in oxide-based electronic materials | Zendy

James M. Rondinelli | Zendy; Kenneth R. Poeppelmeier | Zendy; Alex Zunger | Zendy

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Research Update: Towards designed functionalities in oxide-based electronic materials

Author(s) -

James M. Rondinelli,

Kenneth R. Poeppelmeier,

Alex Zunger

Publication year - 2015

Publication title -

apl materials

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 1.571

H-Index - 60

ISSN - 2166-532X

DOI - 10.1063/1.4928289

Subject(s) - materials science , software deployment , nanotechnology , modalities , transformative learning , oxide , throughput , systems engineering , electronic materials , computer science , engineering , software engineering , psychology , telecommunications , social science , pedagogy , sociology , metallurgy , wireless

One of the grand challenges facing materials-by-design approaches for complex oxide deployment in electronic devices is how to balance transformative first-principles based predictions with experimental feasibility. Here, we briefly review the functionality-driven approach (inverse design) for materials discovery, encapsulated in three modalities for materials discovery (m3D) that integrate experimental feedback. We compare it to both traditional theoretical and high-throughput database-directed approaches aimed at advancing oxide-based materials into technologies

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