Parametrization of LSDA+U for noncollinear magnetic configurations: Multipolar magnetism in UO2

S. L. Dudarev; P. Liu; D. A. Andersson; C. R. Stanek; T. Ozaki; C. Franchini

doi:10.1103/PhysRevMaterials.3.083802

Parametrization of LSDA+U for noncollinear magnetic configurations: Multipolar magnetism in UO2

S. L. Dudarev (Korresp. Autor*in), P. Liu, D. A. Andersson, C. R. Stanek, T. Ozaki, C. Franchini

Computergestützte Materialphysik

Veröffentlichungen: Beitrag in Fachzeitschrift › Artikel › Peer Reviewed

Originalsprache	Englisch
Aufsatznummer	083802
Seitenumfang	14
Fachzeitschrift	Physical Review Materials
Jahrgang	3
Ausgabenummer	8
DOIs	https://doi.org/10.1103/PhysRevMaterials.3.083802
Publikationsstatus	Veröffentlicht - 19 Aug. 2019

ÖFOS 2012

103018 Materialphysik

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10.1103/PhysRevMaterials.3.083802

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title = "Parametrization of LSDA+U for noncollinear magnetic configurations: Multipolar magnetism in UO2",

keywords = "DENSITY-FUNCTIONAL THEORY, SPIN-LATTICE INTERACTION, ELECTRONIC-STRUCTURE, NEUTRON-DIFFRACTION, STRUCTURAL STABILITY, MOLECULAR-DYNAMICS, ANTIFERROMAGNETISM, SPECTRA, SYSTEMS, SURFACE",

author = "Dudarev, {S. L.} and P. Liu and Andersson, {D. A.} and Stanek, {C. R.} and T. Ozaki and C. Franchini",

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doi = "10.1103/PhysRevMaterials.3.083802",

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T2 - Multipolar magnetism in UO2

AU - Dudarev, S. L.

AU - Liu, P.

AU - Andersson, D. A.

AU - Stanek, C. R.

AU - Ozaki, T.

AU - Franchini, C.

PY - 2019/8/19

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KW - DENSITY-FUNCTIONAL THEORY

KW - SPIN-LATTICE INTERACTION

KW - ELECTRONIC-STRUCTURE

KW - NEUTRON-DIFFRACTION

KW - STRUCTURAL STABILITY

KW - MOLECULAR-DYNAMICS

KW - ANTIFERROMAGNETISM

KW - SPECTRA

KW - SYSTEMS

KW - SURFACE

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U2 - 10.1103/PhysRevMaterials.3.083802

DO - 10.1103/PhysRevMaterials.3.083802

M3 - Article

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JF - Physical Review Materials

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Parametrization of LSDA+U for noncollinear magnetic configurations: Multipolar magnetism in UO2

ÖFOS 2012

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