Verified research projects, grant topics and applied computational work.
Development of AI models and high-throughput DFT screening workflows for discovery of caloric and thermoelectric materials, including promising Heusler alloys with enhanced magnetocaloric response.
Calculations of electronic and magnetic properties, thermoelectric performance, spin polarization, chemical and mechanical stability of Heusler alloys.
Modelling of phase transitions and thermal stability of complex alloys using atomistic and first-principles methods.
Study of structure-property relationships in multifunctional alloys and thermodynamic calculations of materials properties.
Machine learning and high-throughput screening algorithms for optimization of magnetocaloric effect in all-d-metal Heusler alloys
oral talk · Baotou, China
Machine Learning algorithms for optimization of magnetocaloric effect in all-d Heusler alloys
oral talk · Dong Hoi, Vietnam
Ab initio study of the 4d Heusler alloy Rh2FeZ
oral talk · Duisburg, Germany
Martensitic transition in 4d Heusler alloys Rh2FeZ
oral talk · Ankara, Turkey
Electronic structure and half-metallicity in Fe2- and Rh2-based Heusler alloys
poster · Moscow, Russia
Half-metallic properties of the Rh2FeZ alloys
poster · Yekaterinburg, Russia