6533b830fe1ef96bd129689a

RESEARCH PRODUCT

Sr Doping and Oxygen Vacancy Formation in La1−xSrxScO3−δ Solid Solutions: Computational Modelling

Yuri A. MastrikovDenis GryaznovGuntars ZvejnieksMaksim SokolovMāra PutniņaEugene A. Kotomin

subject

Inorganic ChemistryF-centreGeneral Chemical Engineering:NATURAL SCIENCES::Physics [Research Subject Categories]General Materials Scienceoxygen stoichiometryoxygen vacancyCondensed Matter PhysicsDFTlanthanum scandate; oxygen vacancy; oxygen stoichiometry; F-centre; DFTlanthanum scandate

description

The study was performed with the financial support from the Latvian Council of Science under the grant agreement LZP-2020/2-0009. Calculations were performed at the HLRS, University of Stuttgart, within the project 12939 DEFTD. The Institute of Solid State Physics, University of Latvia (Latvia), as the Centre of Excellence has received funding from the European Union’s Horizon 2020 Frame-work Programme H2020-WIDESPREAD-01-2016-2017-Teaming Phase2 under grant agreement No. 739508, project CAMART2.

https://doi.org/10.3390/cryst12091300