First-principle calculations of structural and electronic properties of rutile-phase dioxides (MO<Subscript>2</Subscript>), M=Ti, V, Ru, Ir and Sn
Year of publication: |
2009
|
---|---|
Authors: | Hamad, B. A. |
Published in: |
The European Physical Journal B - Condensed Matter and Complex Systems. - Springer. - Vol. 70.2009, 2, p. 163-169
|
Publisher: |
Springer |
Subject: | 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 |
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