Title:	Complex magnetism in transition metal oxychlorides
DNr:	NAISS 2023/22-1158
Project Type:	NAISS Small Compute
Principal Investigator:	Marcus Ekholm <marcus.ekholm@liu.se>
Affiliation:	Linköpings universitet
Duration:	2023-11-03 – 2024-12-01
Classification:	10304
Keywords:

Abstract

We will explore magnetic interactions in a class of quasi-twodimensional magnetic insulators. We will use novel software packages such as TB2J. To this end, we will calculate exchange interactions based on Wannier functions. The goal of the project is to extract and predict magnetic configurations as a function of temperature. This will allow us to understand and describe the magnetic structure of these materials as a function of temperature. These materials feature complex antiferromagnetic orderings and noncollinear configurations.