3 papers
cond-mat.mtrl-sci2025
DFT Investigation of Magnetocrystalline Anisotropy in Fe, Co, Pd0.97Co0.03 and Pd0.97Fe0.03 systems: From Bulk to Thin-Films
Irina I. Piyanzina, Regina M. Burganova, Hayk Zakaryan +3
The nature of low-impurity ferromagnetism remains a challenging problem in the solid-state community due to the strong dependence of magnetic properties on composition, concentrati…
cond-mat.mtrl-sci2025
A DFT study on 18-crown-6-like-N structure as a material for metal-ions storage: stability and performance
Irina I. Piyanzina, Regina M. Burganova, Sadegh Kaviani +2
Developing electrode materials with exceptional electrical conductivity, robust chemical stability, rapid charge and discharge rates, and high storage capacity is essential for adv…
cond-mat.mtrl-sci2024
Material Hardness Descriptor Derived by Symbolic Regression
Christian Tantardini, Hayk A. Zakaryan, Zhong-Kang Han +4
Hardness is a materials' property with implications in several industrial fields, including oil and gas, manufacturing, and others. However, the relationship between this macroscal…