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cond-mat.mtrl-sci2019
First Principles Heisenberg Models of 2D magnetic materials: The Importance of Quantum Corrections to the Exchange Coupling
Daniele Torelli, Thomas Olsen
Magnetic materials are typically described in terms of the Heisenberg model, which provides an accurate account of thermodynamic properties when combined with first principles calc…
cond-mat.mtrl-sci2019
High throughput computational screening for 2D ferromagnetic materials: the critical role of anisotropy and local correlations
Daniele Torelli, Kristian S. Thygesen, Thomas Olsen
The recent observation of ferromagnetic order in two-dimensional (2D) materials has initiated a booming interest in the subject of 2D magnetism. In contrast to bulk materials, 2D m…