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First principles calculation on electronic structure, chemical bonding, elastic and optical properties of novel tungsten triboride

โœ Scribed by Wang, Yi-fu; Xia, Qing-lin; Yu, Yan


Book ID
121546109
Publisher
Central South University
Year
2014
Tongue
English
Weight
509 KB
Volume
21
Category
Article
ISSN
2095-2899

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Electronic structures and optical proper
โœ Z.B. Li; X. Wang; K.L. Yao ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 312 KB

First-principle calculations on the electronic structures and magnetic properties of Na doped in CuInSe 2 with different percentages reveal that the parameters and band gap increase with increasing Na. It reveals that the band gap increases 0.114 eV for 1/8 Cu replaced by Na, which exists in good ag