Gruner, Markus; Entel, Peter:
Nanometre-Scale ab initio investigations of functional magnetic materials
In: NIC Symposium 2014 : Proceedings / Binder, Kurt; Münster, Gernot; Kremer, Manfred (Eds.). - John von Neumann Institute for Computing ; NIC ; 12-13 February 2014, Jülich - Jülich: Forschungzentrum Jülich, 2014 - (NIC Series ; 47), pp. 215 - 222
2014book article/chapter in ProceedingsOA Platinum
Physics (incl. Astronomy)Faculty of PhysicsScientific institutes » Center for Nanointegration Duisburg-Essen (CENIDE)
thp
Title in English:
Nanometre-Scale ab initio investigations of functional magnetic materials
Author:
Gruner, MarkusUDE
GND
128899808
LSF ID
10281
ORCID
0000-0002-2306-1258ORCID iD
Other
connected with university
;Entel, PeterUDE
LSF ID
1127
Other
connected with university
Open Access?:
OA Platinum
WWW URL:
http://juser.fz-juelich.de/record/151286/files/FZJ-2014-01274.pdf
Language of text:
English
Appears in
NIC Symposium 2014 : Proceedings
Conference
John von Neumann Institute for Computing ; NIC ; 12-13 February 2014, Jülich
Editor:
Binder, Kurt;Münster, Gernot;Kremer, Manfred
Place of publication:
Jülich
Publisher:
Forschungzentrum Jülich
Year of publication:
2014
in:
pp. 215 - 222
ISBN
978-3-89336-933-1
In Series
NIC Series
in:
Vol. 47

Abstract in English:

The present survey summarises recent advances in the understanding of the functional properties of application-grade magnetic materials achieved with large-scale density functional theory calculations on the IBM Blue Gene supercomputers at Forschungszentrum Jülich. The discussion focuses on two areas of the project: Structural properties and orbital magnetism of hard-magnetic nanoparticles for data recording applications and the evolution of a nanoscale microstructure in technologically relevant magnetic shape memory systems.