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Electronic Structure and Bonding in Crystalline Y10[SiO4]6N2 (2003)

Ching, Wai-Yim ; Xu, Yong-Nian ; Ouyang, Lizhi

Westerville, Ohio : American Ceramics Society

Journal of the American Ceramic Society 86 (2003), S. 0

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ISSN: 1551-2916

Source: Blackwell Publishing Journal Backfiles 1879-2005

Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Physics

Notes: The electronic structure and bonding of the complex ceramic crystal Y10[SiO4]6N2 is studied by a first-principles method. It is shown that this crystal is an insulator with a direct band gap of 1.3 eV. It has some unique properties related to the one-dimensional chain structure in the c-direction and the planar N-Y bonding in the x-yplane.

Type of Medium: Electronic Resource

URL: http://dx.doi.org/10.1111/j.1151-2916.2003.tb03487.x

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