Changes in the electronic structure and energy of nanoclusters of 3d metals and TiFe and TiNi compounds upon BCC-HCP transformations
Author:
Publisher
Pleiades Publishing Ltd
Subject
Materials Chemistry,Condensed Matter Physics
Link
http://link.springer.com/content/pdf/10.1134/S0031918X06020050.pdf
Reference37 articles.
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3. G. Mpourmpakis, G. Froudakis, A. Andriotis, et al., “Fe Encapsulation by Silicon Clusters: Ab initio Electronic Structure Calculations,” Phys. Rev. B: Condens. Matter Mater. Phys. 68, 125407 (2003).
4. T. Oku, N. Koi, and A. Nishiwaki, “Atomic and Electronic Structures of Multiply Twinned Boron Nitride Nanoparticles with Fivefold Symmetry,” Diamond Relat. Mater. 14, 1193–1197 (2005).
5. C. Majumder and S. Kulshreshtha, “Impurity-Doped Si10 Cluster: Understanding the Structural and Electronic Properties from First-Principles Calculations,” Phys. Rev. B: Condens. Matter Mater. Phys. 70, 245426 (2004).
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