Accurate formation energies of charged defects in solids: A systematic approach-Reference-Cited by-同舟云学术

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Accurate formation energies of charged defects in solids: A systematic approach

Published:2017-06-30 Issue:23 Volume:95 Page:
ISSN:2469-9950
Container-title:Physical Review B
language:en
Short-container-title:Phys. Rev. B

Author:

Vinichenko Dmitry,Sensoy Mehmet Gokhan,Friend Cynthia M.,Kaxiras Efthimios

Funder

Army Research Office

National Science Foundation

Türkiye Bilimsel ve Teknolojik Araştirma Kurumu

Harvard University

Publisher

American Physical Society (APS)

Link

http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.95.235310/fulltext

Reference35 articles.

1. First-principles calculations for point defects in solids

2. First-principles calculations for defects and impurities: Applications to III-nitrides

3. Advances in electronic structure methods for defects and impurities in solids

4. Issues in first-principles calculations for defects in semiconductors and oxides

5. Ab initio theory of point defects in oxide materials: structure, properties, chemical reactivity

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