Iurii Timrov

activity

20242026

most citedFirst-principles Hubbard parameters with automated and reproducible workflows

9 citations · 14 across the 3 of their papers we have counts for

collaborators

Showing 2026Show all

2 papers · 1 filter

cond-mat.mtrl-sci2026

Unraveling the electronic structure and the oxygen $K$ -edge x-ray absorption near-edge structure spectrum of DyFeO $_{3}$

G. Gebreyesus, Eric Macke, Pietro Delugas +5

Rare-earth orthoferrites such as DyFeO $_{3}$ exhibit a rich interplay between localized rare-earth and transition-metal moments, giving rise to complex magnetic phases and magnetoele…

cond-mat.mtrl-sci2026

Assessing the magnetic states and the accuracy of first-principles Hubbard corrections for the battery cathode Li $_{x}$ CoO $_{2}$ ( $x = 0, 1$ )

Valentina Sanella, Cristiano Malica, Alberto Carta +4

Li $_{x}$ CoO $_{2}$ is a prototypical layered cathode material for Li-ion batteries, yet its accurate description from first principles remains challenging because of self-interaction er…

Unraveling the electronic structure and the oxygen K-edge x-ray absorption near-edge structure spectrum of DyFeO3​

Assessing the magnetic states and the accuracy of first-principles Hubbard corrections for the battery cathode Lix​CoO2​ (x=0,1)

Unraveling the electronic structure and the oxygen $K$ -edge x-ray absorption near-edge structure spectrum of DyFeO $_{3}$

Assessing the magnetic states and the accuracy of first-principles Hubbard corrections for the battery cathode Li $_{x}$ CoO $_{2}$ ( $x = 0, 1$ )