most citedThe electronic and magnetic structure of p-element (C,N) doped rutile-TiO; A hybrid DFT study

33 citations · 33 across the 1 of their papers we have counts for

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cond-mat.mtrl-sci2015★ 33 cited

The electronic and magnetic structure of p-element (C,N) doped rutile-TiO; A hybrid DFT study

Jacqueline Atanelov, Christoph Gruber, Peter Mohn

We study the electronic and magnetic structure of carbon and nitrogen impurities and interstitials in rutile TiO. To this end we perform \textit{ab-initio} calculations of a…