Modeling and Numerical Simulation of Material Science

Vol.4 No.2(2014), Paper ID 44356, 17 pages

DOI:10.4236/mnsms.2014.42008

 

Comparison of Functionals for Metal Hexaboride Band Structure Calculations

 

Jose A. Alarco, Peter C. Talbot, Ian D. R. Mackinnon

 

Institute for Future Environments,Queensland University of Technology, Gardens Point Campus, Brisbane,Australia;Science and Engineering Faculty, Queensland University of Technology, Gardens Point Campus, Brisbane,Australia
Institute for Future Environments,Queensland University of Technology, Gardens Point Campus, Brisbane,Australia;Science and Engineering Faculty, Queensland University of Technology, Gardens Point Campus, Brisbane,Australia
Institute for Future Environments,Queensland University of Technology, Gardens Point Campus, Brisbane,Australia

 

Copyright © 2014 Jose A. Alarco, Peter C. Talbot, Ian D. R. Mackinnon et al. This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.

 

How to Cite this Article


Alarco, J. , Talbot, P. and Mackinnon, I. (2014) Comparison of Functionals for Metal Hexaboride Band Structure Calculations. Modeling and Numerical Simulation of Material Science, 4, 53-69. doi: 10.4236/mnsms.2014.42008.

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