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Kevin F. Garrity
Researcher at National Institute of Standards and Technology
Publications - 70
Citations - 4589
Kevin F. Garrity is an academic researcher from National Institute of Standards and Technology. The author has contributed to research in topics: Topological insulator & Silicon. The author has an hindex of 24, co-authored 62 publications receiving 3356 citations. Previous affiliations of Kevin F. Garrity include Yale University & Rutgers University.
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Hexagonal ABC semiconductors as ferroelectrics
TL;DR: A first-principles rational-design approach is used to identify a previously unrecognized class of ferroelectric materials in the P6(3)mc LiGaGe structure type, providing guidance for the experimental realization and further investigation of high-performance materials suitable for practical applications.
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Chern Insulators from Heavy Atoms on Magnetic Substrates
TL;DR: This work proposes searching for Chern insulators by depositing atomic layers of elements with large spin-orbit coupling on the surface of a magnetic insulator, and identifies several candidate systems by using first-principles calculations to compute the Chern number and anomalous Hall conductivity.
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The joint automated repository for various integrated simulations (JARVIS) for data-driven materials design
Kamal Choudhary,Kamal Choudhary,Kevin F. Garrity,Andrew C. E. Reid,Brian L. DeCost,Adam J. Biacchi,Angela R. Hight Walker,Zachary T. Trautt,Jason R. Hattrick-Simpers,A. Gilad Kusne,Andrea Centrone,Albert V. Davydov,Jie Jiang,Ruth Pachter,Gowoon Cheon,Evan J. Reed,Ankit Agrawal,Xiaofeng Qian,Vinit Sharma,Vinit Sharma,Houlong L. Zhuang,Sergei V. Kalinin,Bobby G. Sumpter,Ghanshyam Pilania,Pinar Acar,Subhasish Mandal,Kristjan Haule,David Vanderbilt,Karin M. Rabe,Francesca Tavazza +29 more
TL;DR: The Joint Automated Repository for Various Integrated Simulations (JARVIS) is an integrated infrastructure to accelerate materials discovery and design using density functional theory, classical force-fields, and machine learning techniques.
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Chemistry of Ferroelectric Surfaces
TL;DR: It will be shown that the tendency of the metals to cluster into particles makes it difficult to alter the chemical properties of the metal surface, since it is separated from the ferroelectric by several layers of metal atoms.
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Ferroelectric surface chemistry: First-principles study of the PbTiO 3 surface
TL;DR: In this paper, the authors investigate how the properties of the PbTiO${}_{3}$ surface vary with polarization and how these changes affect CO and H{}_{2}$O adsorption.