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First-principle calculations of structural and electronic properties of rutile-phase dioxides (MO 2 ), M=Ti, V, Ru, Ir and Sn

B. A. Hamad ()

The European Physical Journal B: Condensed Matter and Complex Systems, 2009, vol. 70, issue 2, 163-169

Keywords: 71.15.Mb Density functional theory; local density approximation; gradient and other corrections; 71.15.Nc Total energy and cohesive energy calculations; 71.20.Be Transition metals and alloys (search for similar items in EconPapers)
Date: 2009
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DOI: 10.1140/epjb/e2009-00218-0

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