Cover Image

Effect of Hubbard U corrections on the electronic and magnetic properties of 2D materials: A high-throughput study

Fuente: arXiv

Saved in:

Bibliographic Details
Main Authors:	Pakdel, Sahar, Olsen, Thomas, Thygesen, Kristian S.
Format:	Preprint
Published:	2024
Subjects:	Materials Science Mesoscale and Nanoscale Physics Computational Physics
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Ab initio property characterisation of thousands of previously unknown 2D materials
by: Lyngby, Peder, et al.
Published: (2024)

Efficiency of band edge optical transitions of 2D monolayer materials: A high-throughput computational study
by: Gómez-Bastidas, A. F., et al.
Published: (2024)

Breaking the Moss rule
by: Raza, Søren, et al.
Published: (2026)

Emergent properties of van der Waals bilayers revealed by computational stacking
by: Pakdel, Sahar, et al.
Published: (2023)

On-site and inter-site Hubbard corrections in magnetic monolayers: The case of FePS$_3$ and CrI$_3$
by: Haddadi, Fatemeh, et al.
Published: (2023)

Structural, mechanical, and electronic properties of single graphyne layers based on a 2D biphenylene network
by: Rêgo, Mateus Silva, et al.
Published: (2024)

Effect of arsenic doping on structural and electronic properties of MoSe$_2$ monolayer: an ab initio study
by: Bradji, B., et al.
Published: (2024)

First-principles study of electronic and magnetic properties of self-intercalated van der Waals magnet Cr$_3$Ge$_2$Te$_6$
by: Li, Jia-wan, et al.
Published: (2025)

V$_2$C-based lithium batteries: The influence of magnetic phase and Hubbard interaction
by: González, Jhon W., et al.
Published: (2022)

Crystal structures and electronic and magnetic properties of Janus bilayer Cl3Cr2I3
by: Liu, Suqi, et al.
Published: (2025)

Machine learning assisted high throughput prediction of moiré materials
by: Kaplan, Daniel, et al.
Published: (2025)

Modifying electronic and structural properties of 2D van der Waals materials via cavity quantum vacuum fluctuations: A first-principles QEDFT study
by: Liu, Hang, et al.
Published: (2025)

The 2D Materials Roadmap
by: Ren, Wencai, et al.
Published: (2025)

Role of material-dependent properties in THz field-derivative-torque-induced nonlinear magnetization dynamics
by: Dutta, Arpita, et al.
Published: (2024)

A DFT study of the structural and electronic properties of single and double acceptor dopants in MX2 monolayers
by: Gao, Yuqiang, et al.
Published: (2024)

High-throughput calculations of spin Hall conductivity in non-magnetic 2D materials
by: Zhou, Jiaqi, et al.
Published: (2025)

Which chromium-sulfur compounds exist as 2D material?
by: Safeer, Affan, et al.
Published: (2025)

High-throughput calculations of two-dimensional auxetic $M_4X_8$ with magnetism, electrocatalysis, and alkali metal battery applications
by: Wang, Haidi, et al.
Published: (2025)

Geometry, electronic structure, and optical properties of boron cages: A first-principles DFT study
by: Chavan, Kashinath T., et al.
Published: (2025)

Effect of intense x-ray free-electron laser transient gratings on the magnetic domain structure of Tm:YIG
by: Ukleev, Victor, et al.
Published: (2022)

Structural control of two-level defect density revealed by high-throughput correlative measurements of Josephson junctions
by: Wolff, Oliver F., et al.
Published: (2026)

Quantum light generation with ultra-high spatial resolution in 2D semiconductors via ultra-low energy electron irradiation
by: Dash, Ajit Kumar, et al.
Published: (2024)

Anisotropic electron gas in a hyperbolic van der Waals material
by: Melchioni, Nicola, et al.
Published: (2026)

High-throughput search for topological magnon materials
by: Karaki, Mohammed J., et al.
Published: (2024)

Enhanced magnetic dichroism in darkfield UV photoemission electron microscopy
by: Paleschke, Maximilian, et al.
Published: (2024)

Unveiling the magnetic behavior of C$_{\rm3}$N$_{\rm4}$ 2D material by defect creation, defect passivation, and transition metal adsorption
by: Sakhraoui, Taoufik, et al.
Published: (2025)

Spin relaxation of localized electrons in monolayer MoSe$_2$: importance of random effective magnetic fields
by: Yalcin, Eyüp, et al.
Published: (2024)

Cryogen-free low-temperature photoemission electron microscopy for high-resolution nondestructive imaging of electronic phases
by: Wang, Chen, et al.
Published: (2025)

Exotic properties and manipulation in 2D semimetal Mn2B2(OH)2: a theoretical study
by: Liu, Pingwei, et al.
Published: (2024)

Doping induced magnetism and half-metallicity in nanoribbons of quartic dispersion materials
by: Aliyev, Emin, et al.
Published: (2025)

Enabling two-dimensional electron gas with high room-temperature electron mobility exceeding 100 cm$^2$/Vs at a perovskite oxide interface
by: Hoffmann, Georg, et al.
Published: (2024)

Topological constraints on the electronic band structure of hexagonal lattice in a magnetic field
by: Gao, Qi, et al.
Published: (2025)

Electrically-tunable ultra-flat bands and $π$-electron magnetism in graphene nanoribbons
by: Ma, Ruize, et al.
Published: (2024)

Adaptive multi-spectral mimicking with 2D-material nanoresonator networks
by: Luo, Yujie, et al.
Published: (2024)

Polaron-mediated anisotropic exchange in 2D magnets
by: Carbone, Johanna P., et al.
Published: (2026)

Magnetic and electronic properties of 1D hybrid nanoobjects composed of alternating polycyclic hydrocarbon regions and double carbon chains
by: Lebedeva, Irina V., et al.
Published: (2024)

Polar discontinuities and interfacial electronic properties of Bi$_2$O$_2$Se on SrTiO$_3$
by: Zhu, Ziye, et al.
Published: (2023)

Reconfigurable three dimensional magnetic nanoarchitectures
by: Koraltan, Sabri, et al.
Published: (2025)

Texture tomography, a versatile framework to study crystalline texture in 3D
by: Frewein, M. P. K., et al.
Published: (2024)

Signatures of ballistic and diffusive transport in the time-dependent Kerr-response of magnetic materials
by: Ashok, Sanjay, et al.
Published: (2024)