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20172026
most citedQuantum embedding methods for correlated excited states of point defects: Case studies and challenges

69 citations · 325 across the 19 of their papers we have counts for

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Showing cond-mat.mtrl-sciShow all

8 papers · 1 filter

cond-mat.mtrl-sci2024★ 2 cited

Phonon-induced renormalization of exchange interactions in metallic two-dimensional magnets

Danis I. Badrtdinov, Mikhail I. Katsnelson, Alexander N. Rudenko

The presence of spin-polarized charge carriers in metallic magnets provides a mechanism for spin-lattice interactions mediated by electron-phonon coupling. Here, we present a theor…

cond-mat.mtrl-sci2023

Dielectric environment sensitivity of carbon centres in hexagonal boron nitride

Danis I. Badrtdinov, Carlos Rodriguez-Fernandez, Magdalena Grzeszczyk +11

A key advantage of utilizing van der Waals materials as defect-hosting platforms for quantum applications is the controllable proximity of the defect to the surface or the substrat…

cond-mat.mtrl-sci2023★ 8 cited

An effective spin model on the honeycomb lattice for the description of magnetic properties in two-dimensional FeGeTe

Georgy V. Pushkarev, Danis I. Badrtdinov, Ilia A. Iakovlev +2

FeGeTe attracts significant attention due to technological perspectives of realizing room temperature ferromagnetism in two-dimensional materials. Here we show that due to…

cond-mat.mtrl-sci2023★ 12 cited

Electron transport and scattering mechanisms in ferromagnetic monolayer FeGeTe

Danis I. Badrtdinov, Georgy V. Pushkarev, Mikhail I. Katsnelson +1

We study intrinsic charge-carrier scattering mechanisms and determine their contribution to the transport properties of the two-dimensional ferromagnet FeGeTe. We use state…

cond-mat.mtrl-sci2021★ 69 cited

Quantum embedding methods for correlated excited states of point defects: Case studies and challenges

Lukas Muechler, Danis I. Badrtdinov, Alexander Hampel +3

A quantitative description of the excited electronic states of point defects and impurities is crucial for understanding materials properties, and possible applications of defects…

cond-mat.mtrl-sci2021★ 10 cited

Interplay between breathing-mode distortions and magnetic order in rare-earth nickelates from magnetic models

Danis I. Badrtdinov, Alexander Hampel, Cyrus E. Dreyer

We use density-functional theory calculations to explore the magnetic properties of perovskite rare-earth nickelates, NiO, by constructing microscopic magnetic mod…

cond-mat.mtrl-sci2019★ 13 cited

The origin of up-up-down-down magnetic order in CuGeO

Danis I. Badrtdinov, Vladimir V. Mazurenko, Alexander A. Tsirlin

We use density-functional band-structure calculations to explore the origin of the up-up-down-down (UUDD) magnetic order in CuGeO with the frustrated spin chains…

cond-mat.mtrl-sci2017★ 24 cited

Magnetism of coupled spin tetrahedra in ilinskite-type KCuO(SeO)Cl

Danis I. Badrtdinov, Elena S. Kuznetsova, Valeriy Yu. Verchenko +4

Synthesis, thermodynamic properties, and microscopic magnetic model of ilinskite-type KCuO(SeO)Cl built by corner-sharing Cu tetrahedra are reported, and…