About: Structure and magnetism of iron and iron overlayers from the first principles

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An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

Attributes	Values
rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	A detailed theoretical study of magnetic behavior of iron along the bcc-fcc (Bain's) transformation paths at various atomic volumes is presented. The total energies are calculated by spin-polarized full-potential LAPW method and are displayed in contour plots as functions of tetragonal distortion $c/a$ and volume; borderlines between various magnetic phases are shown. Stability of tetragonal magnetic phases of $\gamma$-Fe is discussed. The calculated phase boundaries are used to predict the lattice parameters and magnetic states of iron overlayers on various (001) substrates. A detailed theoretical study of magnetic behavior of iron along the bcc-fcc (Bain's) transformation paths at various atomic volumes is presented. The total energies are calculated by spin-polarized full-potential LAPW method and are displayed in contour plots as functions of tetragonal distortion $c/a$ and volume; borderlines between various magnetic phases are shown. Stability of tetragonal magnetic phases of $\gamma$-Fe is discussed. The calculated phase boundaries are used to predict the lattice parameters and magnetic states of iron overlayers on various (001) substrates. (en)
Title	Structure and magnetism of iron and iron overlayers from the first principles Structure and magnetism of iron and iron overlayers from the first principles (en)
skos:prefLabel	Structure and magnetism of iron and iron overlayers from the first principles Structure and magnetism of iron and iron overlayers from the first principles (en)
skos:notation	RIV/00216224:14310/01:00005061!RIV/2002/MSM/143102/N
http://linked.open.../vavai/riv/strany	151
http://linked.open...avai/riv/aktivita	P Z
http://linked.open...avai/riv/aktivity	P(GA106/99/1178), P(IAA1010817), P(ME 264), P(OC P3.10), Z(AV0Z2041904)
http://linked.open...vai/riv/dodaniDat	2002
http://linked.open...aciTvurceVysledku	Friák, Martin
http://linked.open.../riv/druhVysledku	D - Článek ve sborníku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Masarykova univerzita / Přírodovědecká fakulta
http://linked.open...dnocenehoVysledku	697471
http://linked.open...ai/riv/idVysledku	RIV/00216224:14310/01:00005061
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	ab initio, iron overlayers, magnetism (en)
http://linked.open.../riv/klicoveSlovo	ab initio magnetism iron overlayers
http://linked.open...ontrolniKodProRIV	[2D102B870F56]
http://linked.open...v/mistoKonaniAkce	Brno, Česká republika
http://linked.open...i/riv/mistoVydani	Brno, Česká republika
http://linked.open...i/riv/nazevZdroje	Proc. 3rd Int. Conf. on Materials Structure & Micromechanics of Fracture
http://linked.open...in/vavai/riv/obor	BM
http://linked.open...ichTvurcuVysledku	1 (xsd:int)
http://linked.open...cetTvurcuVysledku	3 (xsd:int)
http://linked.open...ocetUcastnikuAkce	0 (xsd:int)
http://linked.open...nichUcastnikuAkce	0 (xsd:int)
http://linked.open...vavai/riv/projekt	Experimental and theoretical studies of grain boundary segregation http://linked.opendata.cz/resource/domain/vavai/projekt/ME%20264 http://linked.opendata.cz/resource/domain/vavai/projekt/OC%20P3.10 Stability of crystal structures and lattice defects in intermetallics
http://linked.open...UplatneniVysledku	2001
http://linked.open...iv/tvurceVysledku	Friák, Martin Šob, Mojmír Vitek, Václav
http://linked.open...vavai/riv/typAkce	WRD - Světová
http://linked.open.../riv/zahajeniAkce	2001-01-01 (xsd:date)
http://linked.open...n/vavai/riv/zamer	Behavior and properties of metallic and non-metallic materials in relation to their structure, research on processes leading to degradation of material quality
number of pages	9 (xsd:int)
http://purl.org/ne...btex#hasPublisher	P. Sandera
https://schema.org/isbn	80-214-1892-3
http://localhost/t...ganizacniJednotka	14310

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