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- University of ViennaAT30 papers
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4 papers · 2 filters
Observation and destruction of an elusive adsorbate with STM: O/TiO
Philipp Scheiber, Alexander Riss, Michael Schmid +2
When a slightly defective rutile TiO(110) surface is exposed to O at elevated temperatures, the molecule dissociates at defects, filling O vacancies (\ov) and creating O ad…
Metamaterials proposed as perfect magnetoelectrics
A. M. Shuvaev, S. Engelbrecht, M. Wunderlich +2
Magnetoelectric susceptibility of a metamaterial built from split ring resonators have been investigated both experimentally and within an equivalent circuit model. The absolute va…
Systematic investigation of a family of gradient-dependent functionals for solids
Philipp Haas, Fabien Tran, Peter Blaha +4
Eleven density functionals are compared with regard to their performance for the lattice constants of solids. We consider standard functionals, such as the local-density approximat…
Spin-orbit coupling induced anisotropy effects in bimetallic antiferromagnets: A route towards antiferromagnetic spintronics
Alexander B. Shick, Sergii Khmelevskyi, Oleg N. Mryasov +2
Magnetic anisotropy phenomena in bimetallic antiferromagnets MnAu and MnIr are studied by first-principles density functional theory calculations. We find strong and lattice-pa…