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High-pressure phases and structural bonding ofGe3N4

1999/10/31 by Ihor A. Lubashevsky, J. E. Lowther, Reinhard Mahnke · 1 citation
Earth and Planetary Sciences · Materials Science · Mathematics · Physics and Astronomy · #Advanced Fiber Laser Technologies #Algorithm #Artificial intelligence #Cluster (spacecraft) #Computer science #Context (archaeology) #Diamond and Carbon-based Materials Research #Flow (mathematics) #Geology #Geometry #High-pressure geophysics and materials #Mathematics #Motion (physics) #Phase transition #Physics #Statistical physics #Thermodynamics #cond-mat.soft #cond-mat.stat-mech

paper · pdf · doi:10.1103/physrevb.62.5

published as Physical Review E, v. 62, n. 5, pp. 6082-6093 (2000) · REVTeX 3.1, 10 pages with 10 PostScript figures

openalex publication_date 2000/07/01 · arxiv created 2000/11/13 · arxiv updated 2009/11/30 · openalex created_date 2016/06/24 · openalex updated_date 2026/08/05

Abstract

The spinel structure of Ge3N4 is compared with that of \ensuremathβ\ensuremath-Ge3N4 and a cubic defect zinc-blende structure recently considered possible for C3N4. The \ensuremathβ phase is suggested to be a possible precursor phase to the spinel structure. Electronic structure calculations reveal that the spinel structure is a subtle extension of the defect zinc-blende phase in which the Ge atoms attempt to connect into the conventional zinc-blende structure.

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