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Structural, electronic, vibrational, and elastic properties of SWCNTs doped with B and N: an ab initio study

✍ Scribed by Raúl Arturo Espejel-Morales,Sinhué López-Moreno…

Book ID
126369804
Publisher
Springer
Year
2013
Tongue
English
Weight
671 KB
Volume
67
Category
Article
ISSN
1434-6060

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Ab initio study of structural, elastic, electronic and optical properties of spinel SnMg2O4
✍ M. Reffas; A. Bouhemadou; R. Khenata; T. Ouahrani; S. Bin-Omran 📂 Article 📅 2010 🏛 Elsevier Science 🌐 English ⚖ 412 KB

Ab initio study of structural, elastic, electronic and optical properties of the cubic spinel oxide SnMg 2 O 4 has been reported using the pseudo-potential plane-wave method within the local density approximation and the gradient generalized approximation for the exchange and correlation potential.