Magnetic Properties of CaMnO3 Layers on the (100) Surface of BaTiO3
| Autor: | E. K. Mikhailenko, S. M. Dunaevsky |
|---|---|
| Rok vydání: | 2018 |
| Předmět: |
010302 applied physics
Materials science Condensed matter physics Ab initio Heterojunction Electronic structure Condensed Matter::Mesoscopic Systems and Quantum Hall Effect Manganite 01 natural sciences Semimetal Surfaces Coatings and Films Condensed Matter::Materials Science Ferromagnetism 0103 physical sciences Antiferromagnetism Condensed Matter::Strongly Correlated Electrons Density functional theory 010306 general physics |
| Zdroj: | Journal of Surface Investigation: X-ray, Synchrotron and Neutron Techniques. 12:200-203 |
| ISSN: | 1819-7094 1027-4510 |
| DOI: | 10.1134/s1027451018020064 |
| Popis: | “Ab-initio” calculations of the electronic structure of the heterojunction (001) between cubic CaMnO3 and BaTiO3 perovskites are performed on the basis of density functional theory for different variants of magnetic ordering in calcium manganite. The paper considers some cases of ferromagnetic and antiferromagnetic A-type ordering. Comparison of the total energies of these structures shows that antiferromagnetic ordering in CaMnO3 is the most favorable. All the studied structures in a ferromagnetic state are half-metallic ferromagnets. |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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