JuLib | Articles & more - {"JARA

1

Phonons from density-functional perturbation theory using the all-electron full-potential linearized augmented plane-wave method FLEUR *

Gerhorst, Christian-Roman
2024

Electronic structure, 6 (2024) 1, S. 017001 -

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

2

Journal Article

Atomic Diffusion-Induced Polarization and Superconductivity in Topological Insulator-Based Heterostructures

Wei, Xiankui
2024

ACS nano, 18 (2024) 1, S. 571-580

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

3

Journal Article

How to verify the precision of density-functional-theory implementations via reproducible and universal workflows

Bosoni, Emanuele
2024

Nature reviews / Physics, 6 (2024) S. 45-58

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess Restricted

4

Journal Article

Long-Range Orbital Torque by Momentum-Space Hotspots

Go, Dongwook
2023

Physical review letters, 130 (2023) 24, S. 246701

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

5

Journal Article

Interorbital Cooper pairing at finite energies in Rashba surface states

Rüssmann, Philipp
2023

Physical review research, 5 (2023) 4, S. 043181

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

6

Preprint

Flat band-engineered spin-density wave and the emergent multi-$k$ magnetic state in the topological kagome metal Mn$_{3}$Sn

Wang, Xiao
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

7

Conference Presentation

Elucidating the Mechanism of the Magnetocaloric Effect in Compounds of the Series Mn5-xFexSi3

Friese, Karen
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

8

Journal Article

Photocurrents, inverse Faraday effect, and photospin Hall effect in Mn2Au

Mokrousov, Yuriy
2023

APL materials, 11 (2023) 7, S. 071106

“...JARA - HPC; JARA-HPC JARA - HPC...”
Get full text OpenAccess

9

Journal Article

Heliknoton in a film of cubic chiral magnet

Kuchkin, Vladyslav
2023

Frontiers in physics, 11 (2023) S. 1201018

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

10

Dataset

How to verify the precision of density-functional-theory implementations via reproducible and universal workflows

Bosoni, Emanuele
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

11

Conference Presentation

Recent Progress of theFull-Potential Linearized Augmented Plane-Wave (FLAPW) Method

Blügel, Stefan
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

12

Journal Article

Double- Q ground state with topological charge stripes in the centrosymmetric skyrmion candidate GdRu 2 Si 2

Wood, G. D. A.
2023

Physical review / B, 107 (2023) 18, S. L180402

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

13

Journal Article

Ultrafast optical generation of antiferromagnetic meron-antimeron pairs with conservation of topological charge

Ghosh, Sumit
2023

Physical review research, 5 (2023) 2, S. L022007

“...JARA - HPC; JARA-HPC JARA - HPC...”
Get full text OpenAccess

14

Poster

Atomistic Simulation of ionic liquids as novel fuel cell electrolytes

Parisi, Federico
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

15

Talk (non-conference)

Modeling of Energy Materials: Lessons learned from Geoscience

Kowalski, Piotr
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

16

Conference Presentation

Refined DFT＋U Method for Computation of Layered Oxide Cathode Materials

Ting, Yin-Ying
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

17

Poster

Understanding electrocatalytic behavior of Fe:NiOOH catalysts for the oxygen evolution reaction

Tesch, Rebekka
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

18

Conference Presentation

Towards accurate computation of charged electrochemical interfaces at realistic reaction conditions

Tesch, Rebekka
2023

“...JARA - HPC; JARA-HPC JARA - HPC...”

19

Journal Article

Refined DFT＋ U method for computation of layered oxide cathode materials

Ting, Yin-Ying
2023

Electrochimica acta, 443 (2023) S. 141912 -

“...JARA - HPC; JARA-HPC JARA - HPC...”

20

Journal Article

Low-spin state of Fe in Fe-doped NiOOH electrocatalysts

He, Zhengda
2023

Nature Communications, 14 (2023) 1, S. 3498

“...JARA - HPC; JARA-HPC JARA - HPC...”
OpenAccess

Narrow Search Results