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First-principle studies of structural and electronic properties of layered B3C10N3

✍ Scribed by Dongxu Li; Dongli Yu; Quan Huang; Julong He; Bo Xu; Zhongyuan Liu; Yongjun Tian

Book ID
116375483
Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
674 KB
Volume
47
Category
Article
ISSN
0927-0256

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## Abstract The structural and electronic properties of layered C~3~N compound have been studied using ab initio pseudopotential density‐functional method within the local‐density approximation. Total energy, lattice constant, band structure, and electron density of state are calculated. Among thre