Olle Eriksson
Professor at Department of Physics and Astronomy; Materials Theory
- Telephone:
- +46 18 471 36 25
- Mobile phone:
- +46 70 425 07 77
- E-mail:
- olle.eriksson@physics.uu.se
- Visiting address:
- Ångströmlaboratoriet, Regementsvägen 10
752 37 Uppsala - Postal address:
- Box 524
751 20 UPPSALA
Professor at Department of Physics and Astronomy; Materials Theory; Materials Theory
- Telephone:
- +46 18 471 36 25
- Mobile phone:
- +46 70 425 07 77
- E-mail:
- olle.eriksson@physics.uu.se
- Visiting address:
- Ångströmlaboratoriet, Regementsvägen 10
752 37 Uppsala - Postal address:
- Box 524
751 20 UPPSALA
Biography
Research Interests
First principles calculations of bulk and surfaces, including magnetism and chemical bonding. Methods of use are based on full-potential implementations of density functional theory, dynamical mean-field theory, and self-interaction correction. Calculations of finite temperature magnetism including Monte Carlo simulations and atomistic spin-dynamics simulations. Lattice dynamics and finite temperature effects of phase stability.
Selected Publications
- Sato et al., First-principles theory of dilute magnetic semiconductors Rev. Mod. Phys. 82, 1633 (2010).
- Bergman et al., Magnon softening in a ferromagnetic monolayer: A first-principles spin dynamics study Phys. Rev. B 81, 144416 (2010).
- Sanyal et al., Forcing Ferromagnetic Coupling Between Rare-Earth-Metal and 3d Ferromagnetic Films Phys. Rev. Lett. 104, 156402 (2010).

Publications
Recent publications
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Magnon shake-up: entanglement generation and sensing
Part of npj Computational Materials, 2026
- DOI for Magnon shake-up: entanglement generation and sensing
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Unraveling the symmetry of Al5C3N
Part of Acta Crystallographica. Section B, p. 299-309, 2026
- DOI for Unraveling the symmetry of Al5C3N
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Giant Rashba splitting in a 2D BiAs layer on InAs(111)B
Part of Communications Materials, 2026
- DOI for Giant Rashba splitting in a 2D BiAs layer on InAs(111)B
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Light-induced bimerons in a chiral magnet
Part of Nature Communications, 2026
- DOI for Light-induced bimerons in a chiral magnet
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Part of npj 2D Materials and Applications, 2026
- DOI for Complex magnetic exchange, anisotropy and skyrmionic textures in 2D ferromagnets with transition metals and chalcogens
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All publications
Articles in journal
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Magnon shake-up: entanglement generation and sensing
Part of npj Computational Materials, 2026
- DOI for Magnon shake-up: entanglement generation and sensing
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Unraveling the symmetry of Al5C3N
Part of Acta Crystallographica. Section B, p. 299-309, 2026
- DOI for Unraveling the symmetry of Al5C3N
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Giant Rashba splitting in a 2D BiAs layer on InAs(111)B
Part of Communications Materials, 2026
- DOI for Giant Rashba splitting in a 2D BiAs layer on InAs(111)B
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Light-induced bimerons in a chiral magnet
Part of Nature Communications, 2026
- DOI for Light-induced bimerons in a chiral magnet
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Part of npj 2D Materials and Applications, 2026
- DOI for Complex magnetic exchange, anisotropy and skyrmionic textures in 2D ferromagnets with transition metals and chalcogens
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Part of Scientific Reports, 2026
- DOI for Impact of pressure on the structural, Raman, superconducting, and normal state resistivity properties of Y5Rh6Sn18 quasi-skutterudite single crystal
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Electric-Current-Assisted Nucleation of Zero-Field Hopfion Rings
Part of Advanced Materials, 2026
- DOI for Electric-Current-Assisted Nucleation of Zero-Field Hopfion Rings
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New insights into the magnetism of DyCo5
Part of Acta Materialia, 2026
- DOI for New insights into the magnetism of DyCo5
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Inequivalence of Landau-Lifshitz and Landau-Lifshitz-Gilbert dynamics for a single quantum spin
Part of Physical Review B, 2026
- DOI for Inequivalence of Landau-Lifshitz and Landau-Lifshitz-Gilbert dynamics for a single quantum spin
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Linked skyrmions in shifted magnetic bilayer
Part of Communications Physics, 2026
- DOI for Linked skyrmions in shifted magnetic bilayer
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Topological metal-insulator transition within the ferromagnetic state
Part of Nature Communications, 2026
- DOI for Topological metal-insulator transition within the ferromagnetic state
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Part of Journal of Physics and Chemistry of Solids, 2026
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Dynamical electronic correlations and chiral magnetism in the van der Waals magnet Fe4GeTe2
Part of Physical Review B, 2025
- DOI for Dynamical electronic correlations and chiral magnetism in the van der Waals magnet Fe4GeTe2
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Nodal hybridization in a two-dimensional heavy-fermion material
Part of Nature Physics, p. 1949-1956, 2025
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Bi trimers and self-limiting Bi-Sb interface formation upon Bi deposition on InSb(111)B surfaces
Part of Surfaces and Interfaces, 2025
- DOI for Bi trimers and self-limiting Bi-Sb interface formation upon Bi deposition on InSb(111)B surfaces
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Part of Journal of Materials Chemistry A, p. 29317-29322, 2025
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Quantitative theory of magnetic properties of elemental praseodymium
Part of npj Computational Materials, 2025
- DOI for Quantitative theory of magnetic properties of elemental praseodymium
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Part of Physical Review Letters, 2025
- DOI for Anomalous Pressure Dependence of the Charge Density Wave and Fermi Surface Reconstruction in BaFe2Al9
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Hybrid micromagnetic and atomistic modeling of magnetization dynamics induced by engineered defects
Part of Scientific Reports, 2025
- DOI for Hybrid micromagnetic and atomistic modeling of magnetization dynamics induced by engineered defects
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Design of 2D skyrmionic metamaterials through controlled assembly
Part of npj Computational Materials, 2025
- DOI for Design of 2D skyrmionic metamaterials through controlled assembly
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Charge-transfer properties and electron dynamics in ferromagnetic CoS2
Part of Physical Review B, 2025
- DOI for Charge-transfer properties and electron dynamics in ferromagnetic CoS2
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Ultrafast demagnetization dynamics of 4f antiferromagnets
Part of Physical Review Materials, 2025
- DOI for Ultrafast demagnetization dynamics of 4f antiferromagnets
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Part of Advanced Science, 2025
- DOI for Correlations in Magnetic Sub-Domains as an Unconventional Phase Diagram for van der Waals Ferromagnets
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MFe6X4 system (M = Mg, Sc, Zr; X = Al, Si, P, Ga, Ge, In, Sn, Sb) as possible ‘gap’ magnets
Part of Science and Technology of Advanced Materials, 2025
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Part of Acta Materialia, 2025
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Part of Physical Review B, 2025
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Magnetocaloric properties of ternary Al-Mn-Co alloys
Part of Journal of Alloys and Compounds, 2025
- DOI for Magnetocaloric properties of ternary Al-Mn-Co alloys
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Part of Journal of Physics and Chemistry of Solids, 2025
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Design of thermal hysteresis in nonstoichiometric Fe2P-type alloys with giant magnetocaloric effect
Part of Physical Review B, 2025
- DOI for Design of thermal hysteresis in nonstoichiometric Fe2P-type alloys with giant magnetocaloric effect
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Machine learning for improved density functional theory thermodynamics
Part of Scientific Reports, 2025
- DOI for Machine learning for improved density functional theory thermodynamics
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Spin-lattice couplings in 3d ferromagnets: Analysis from first principles
Part of Physical Review Materials, 2025
- DOI for Spin-lattice couplings in 3d ferromagnets: Analysis from first principles
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Part of Nature Communications, 2025
- DOI for Tuning ultrafast demagnetization with ultrashort spin polarized currents in multi-sublattice ferrimagnets
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Part of Physical Review B, 2025
- DOI for Topological invariants of vortices, merons, skyrmions, and their combinations in continuous and discrete systems
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Part of Physical Review B, 2025
- DOI for How quantum selection rules influence the magneto-optical effects of driven ultrafast magnetization dynamics
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Lattice and spin entropy changes in B2-type magnetocaloric Al-Mn-Ni alloy
Part of Journal of Physics D, 2025
- DOI for Lattice and spin entropy changes in B2-type magnetocaloric Al-Mn-Ni alloy
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Advanced materials provide solutions towards a sustainable world
Part of Nature Materials, p. 160-161, 2024
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Theory of x-ray absorption spectroscopy for ferrites
Part of Physical Review B, 2024
- DOI for Theory of x-ray absorption spectroscopy for ferrites
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Part of npj Computational Materials, 2024
- DOI for Dzyaloshinskii-Moriya interactions, Néel skyrmions and V4 magnetic clusters in multiferroic lacunar spinel GaV4S8
- Download full text (pdf) of Dzyaloshinskii-Moriya interactions, Néel skyrmions and V4 magnetic clusters in multiferroic lacunar spinel GaV4S8
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Zero-field magnetic skyrmions in exchange-biased ferromagnetic-antiferromagnetic bilayers
Part of Journal of Physics, 2024
- DOI for Zero-field magnetic skyrmions in exchange-biased ferromagnetic-antiferromagnetic bilayers
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Role of pressure-induced stacking faults on the magnetic properties of gadolinium
Part of Physical Review B, 2024
- DOI for Role of pressure-induced stacking faults on the magnetic properties of gadolinium
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Giant magnetocaloric effect in the (Mn,Fe)NiSi-system
Part of Physical Review Materials, 2024
- DOI for Giant magnetocaloric effect in the (Mn,Fe)NiSi-system
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Quantum Analog of Landau-Lifshitz-Gilbert Dynamics
Part of Physical Review Letters, 2024
- DOI for Quantum Analog of Landau-Lifshitz-Gilbert Dynamics
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Chemical disorder effects on Gilbert damping of FeCo alloys
Part of Physical Review B, 2024
- DOI for Chemical disorder effects on Gilbert damping of FeCo alloys
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Part of Physical Review B, 2024
- DOI for Topological magnon in exchange frustration driven incommensurate spin spiral of kagome-lattice YMn6Sn6
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Coupled spin-lattice dynamics from the tight-binding electronic structure
Part of Physical Review B, 2024
- DOI for Coupled spin-lattice dynamics from the tight-binding electronic structure
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Quantum spin systems: Toroidal classification and geometric duality
Part of Physical Review B, 2024
- DOI for Quantum spin systems: Toroidal classification and geometric duality
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The Crystal Structure of Al4SiC4 Revisited
Part of Inorganic Chemistry, p. 10490-10499, 2024
- DOI for The Crystal Structure of Al4SiC4 Revisited
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Understanding the nature of the magnetic coupling in transition metal doped Bi2Se3
Part of Physical Review B, 2024
- DOI for Understanding the nature of the magnetic coupling in transition metal doped Bi2Se3
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Tunable topological magnetism in superlattices of nonmagnetic B20 systems
Part of Physical Review B, 2024
- DOI for Tunable topological magnetism in superlattices of nonmagnetic B20 systems
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Three-dimensional magnetic nanotextures with high-order vorticity in soft magnetic wireframes
Part of Nature Communications, 2024
- DOI for Three-dimensional magnetic nanotextures with high-order vorticity in soft magnetic wireframes
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Part of Nano Letters, p. 5562-5569, 2024
- DOI for From Insulator to Superconductor: A Series of Pressure-Driven Transitions in Quasi-One-Dimensional TiS3 Nanoribbons
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Charging behavior of ZnMn2O4 and LiMn2O4 in a zinc- and lithium-ion battery: an ab initio study
Part of Journal of Physics, 2024
- DOI for Charging behavior of ZnMn2O4 and LiMn2O4 in a zinc- and lithium-ion battery: an ab initio study
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Coupled atomistic spin-lattice simulations of ultrafast demagnetization in 3d ferromagnets
Part of Scientific Reports, 2024
- DOI for Coupled atomistic spin-lattice simulations of ultrafast demagnetization in 3d ferromagnets
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Two-dimensional heavy fermions in the van der Waals metal CeSiI
Part of Nature, p. 483-488, 2024
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Atom-specific magnon driven ultrafast spin dynamics in Fe1-xNix alloys
Part of Physical Review B, 2023
- DOI for Atom-specific magnon driven ultrafast spin dynamics in Fe1-xNix alloys
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The interplay of local electron correlations and ultrafast spin dynamics in fcc Ni
Part of Materials Research Letters, p. 655-661, 2023
- DOI for The interplay of local electron correlations and ultrafast spin dynamics in fcc Ni
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Tuneable 2D surface Bismuth incorporation on InAs nanosheets
Part of Nanoscale, p. 9551-9559, 2023
- DOI for Tuneable 2D surface Bismuth incorporation on InAs nanosheets
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A 2D Bismuth-Induced Honeycomb Surface Structure on GaAs(111)
Part of ACS Nano, p. 5047-5058, 2023
- DOI for A 2D Bismuth-Induced Honeycomb Surface Structure on GaAs(111)
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Resistive switching in graphene: A theoretical case study on the alumina-graphene interface
Part of Physical Review Research, 2023
- DOI for Resistive switching in graphene: A theoretical case study on the alumina-graphene interface
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Part of Science Advances, 2023
- DOI for Optically controlling the competition between spin flips and intersite spin transfer in a Heusler half-metal on sub-100-fs time scales
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Robustness of Trion State in Gated Monolayer MoSe2 under Pressure
Part of Nano Letters, p. 10282-10289, 2023
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Transmon probe for quantum characteristics of magnons in antiferromagnets
Part of Physical Review B, 2023
- DOI for Transmon probe for quantum characteristics of magnons in antiferromagnets
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High-Temperature Mechanical and Dynamical Properties of gamma-(U,Zr) Alloys
Part of Materials, 2023
- DOI for High-Temperature Mechanical and Dynamical Properties of gamma-(U,Zr) Alloys
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The effect of longitudinal spin-fluctuations on high temperature properties of Co3Mn2Ge
Part of Scripta Materialia, 2023
- DOI for The effect of longitudinal spin-fluctuations on high temperature properties of Co3Mn2Ge
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Metaheuristic conditional neural network for harvesting skyrmionic metastable states
Part of Physical Review Research, 2023
- DOI for Metaheuristic conditional neural network for harvesting skyrmionic metastable states
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Magnetism in AV3Sb5 (A = Cs, Rb, and K): Origin and Consequences for the Strongly Correlated Phases
Part of Physical Review Letters, 2023
- DOI for Magnetism in AV3Sb5 (A = Cs, Rb, and K): Origin and Consequences for the Strongly Correlated Phases
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Part of Materials Research Letters, p. 76-83, 2023
- DOI for Fe2C- and Mn-2(W/Mo)B-4-based rare-earth-free permanent magnets as a result of the high-throughput and data-mining search
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Genetic-tunneling driven energy optimizer for spin systems
Part of Communications Physics, 2023
- DOI for Genetic-tunneling driven energy optimizer for spin systems
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Part of Physical Review B, 2023
- DOI for Unraveling the connection between high-order magnetic interactions and local-to-global spin Hamiltonian in noncollinear magnetic dimers
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Part of ACS Applied Nano Materials, p. 10402-10412, 2023
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Tunable phonon-driven magnon-magnon entanglement at room temperature
Part of New Journal of Physics, 2023
- DOI for Tunable phonon-driven magnon-magnon entanglement at room temperature
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Influence of nonlocal damping on magnon properties of ferromagnets
Part of Physical Review B, 2023
- DOI for Influence of nonlocal damping on magnon properties of ferromagnets
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Correlated quantum dynamics of graphene clusters
Part of Physical Review B, 2023
- DOI for Correlated quantum dynamics of graphene clusters
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Part of Acta Materialia, 2023
- DOI for Stable and metastable rare-earth-free permanent magnets from a database of predicted crystal structures
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Magnetism in AV3Sb5 (A = Cs, Rb, K): Complex landscape of dynamical magnetic textures
Part of Physical Review B, 2023
- DOI for Magnetism in AV3Sb5 (A = Cs, Rb, K): Complex landscape of dynamical magnetic textures
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Part of Applied Physics Letters, 2023
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Stable Sulfuric Vapor Transport and Liquid Sulfur Growth on Transition Metal Dichalcogenides
Part of Crystal Growth & Design, p. 2287-2294, 2023
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Part of Journal of Alloys and Compounds, 2023
- DOI for Investigation of the metastable spinodally decomposed magnetic CrFe-rich phase in Al doped CrFeCoNi alloy
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Atom-specific magnon-driven ultrafast spin dynamics in Fe1-xNix alloys
Part of Physical Review B, 2023
- DOI for Atom-specific magnon-driven ultrafast spin dynamics in Fe1-xNix alloys
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Site-specific atomic substitution in a giant magnetocaloric Fe2P-type system
Part of Physical Review B, 2023
- DOI for Site-specific atomic substitution in a giant magnetocaloric Fe2P-type system
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Part of Physical Review B, 2023
- DOI for Magnetic circular dichroism in the dd excitation in the van der Waals magnet CrI3 probed by resonant inelastic x-ray scattering
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Part of Journal of Physics and Chemistry of Solids, 2023
- DOI for Pressure effect on the structural, electronic, and magnetic properties of the battery cathode material LiMn2O4: An ab-initio study
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Magnetic properties of NdFe11Ti and YFe11Ti, from experiment and theory
Part of Acta Materialia, 2023
- DOI for Magnetic properties of NdFe11Ti and YFe11Ti, from experiment and theory
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Part of Journal of Physics D, 2023
- DOI for On the structural and magnetic properties of Al-rich high entropy alloys: a joint experimental-theoretical study
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1D/2D Hybrid Te/Graphene and Te/MoS2: Multifaceted Broadband Photonics and Green-Energy Applications
Part of ACS Applied Materials and Interfaces, p. 51449-51458, 2022
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Part of ACS Applied Materials and Interfaces, p. 36209-36216, 2022
- DOI for Insights and Implications of Intricate Surface Charge Transfer and sp3-Defects in Graphene/Metal Oxide Interfaces
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Element-selective ultrafast magnetization dynamics of hybrid Stoner-Heisenberg magnets
Part of Physical Review B, 2022
- DOI for Element-selective ultrafast magnetization dynamics of hybrid Stoner-Heisenberg magnets
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Ultrafast manipulation of the NiO antiferromagnetic order via sub-gap optical excitation
Part of Faraday discussions, p. 300-316, 2022
- DOI for Ultrafast manipulation of the NiO antiferromagnetic order via sub-gap optical excitation
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Re-Dichalcogenides: Resolving Conflicts of Their Structure-Property Relationship
Part of Advanced Physics Research, 2022
- DOI for Re-Dichalcogenides: Resolving Conflicts of Their Structure-Property Relationship
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Realistic first-principles calculations of the magnetocaloric effect: applications to hcp Gd
Part of Materials Research Letters, p. 156-162, 2022
- DOI for Realistic first-principles calculations of the magnetocaloric effect: applications to hcp Gd
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Structural and electronic properties of the random alloy ZnSexS1-x
Part of Physical Review B, 2022
- DOI for Structural and electronic properties of the random alloy ZnSexS1-x
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Part of Physical Review B, 2022
- DOI for Adiabatic spin dynamics and effective exchange interactions from constrained tight-binding electronic structure theory: Beyond the Heisenberg regime
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Comment on "Proper and improper chiral magnetic interactions"
Part of Physical Review B, 2022
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Tuning skyrmions in B20 compounds by 4d and 5d doping
Part of Physical Review Materials, 2022
- DOI for Tuning skyrmions in B20 compounds by 4d and 5d doping
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Ultrafast modification of the electronic structure of a correlated insulator
Part of Physical Review Research, 2022
- DOI for Ultrafast modification of the electronic structure of a correlated insulator
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Exotic magnetic and electronic properties of layered CrI3 single crystals under high pressure
Part of Physical Review B, 2022
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Heat-conserving three-temperature model for ultrafast demagnetization in nickel
Part of Physical Review B, 2022
- DOI for Heat-conserving three-temperature model for ultrafast demagnetization in nickel
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Entanglement duality in spin-spin interactions
Part of Physical Review A: covering atomic, molecular, and optical physics and quantum information, 2022
- DOI for Entanglement duality in spin-spin interactions
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Revealing the Magnetic Structure and Properties of Mn(Co,Ge)2
Part of Inorganic Chemistry, p. 17673-17681, 2022
- DOI for Revealing the Magnetic Structure and Properties of Mn(Co,Ge)2
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Exchange scaling of ultrafast angular momentum transfer in 4f antiferromagnets
Part of Nature Materials, p. 514, 2022
- DOI for Exchange scaling of ultrafast angular momentum transfer in 4f antiferromagnets
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Thermally induced magnetic order from glassiness in elemental neodymium
Part of Nature Physics, p. 905-911, 2022
- DOI for Thermally induced magnetic order from glassiness in elemental neodymium
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Part of Journal of Alloys and Compounds, 2021
- DOI for High-throughput compatible approach for entropy estimation in magnetocaloric materials: FeRh as a test case
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Quantifying Spin-Mixed States in Ferromagnets
Part of Physical Review Letters, 2021
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Exchange constants for local spin Hamiltonians from tight-binding models
Part of Physical Review B, 2021
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Part of Physical Review B, 2021
- DOI for Heisenberg and anisotropic exchange interactions in magnetic materials with correlated electronic structure and significant spin-orbit coupling
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Magnetocaloric properties of melt-spun MnFe-rich high-entropy alloy
Part of Applied Physics Letters, 2021
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Local structural evolution in the anionic solid solution ZnSexS1-x
Part of Physical Review B, 2021
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In Situ Pseudopotentials for Electronic Structure Theory
Part of The Journal of Physical Chemistry C, p. 15103-15111, 2021
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Alloying effect on the order-disorder transformation in tetragonal FeNi
Part of Scientific Reports, 2021
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Magnetic Damping in Polycrystalline Thin-Film Fe-V Alloys
Part of Physical Review Applied, 2021
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Part of Physical Review B, 2021
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Connection between magnetic interactions and the spin-wave gap of the insulating phase of NaOsO3
Part of Physical Review B, 2021
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Photoelectron dispersion in metallic and insulating VO2 thin films
Part of Physical Review Research, 2021
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Mechanisms behind large Gilbert damping anisotropies
Part of Physical Review B, 2021
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Ab-initio study of the electronic structure and magnetic properties of Ce2Fe17
Part of Journal of Alloys and Compounds, 2021
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Data-driven design of a new class of rare-earth free permanent magnets
Part of Acta Materialia, 2021
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Vibrational entropy-enhanced magnetocaloric effect in Mn-rich high-entropy alloys
Part of Applied Physics Letters, 2021
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Majority gate for two-dimensional ferromagnets lacking inversion symmetry
Part of Physical Review Research, 2021
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Magnon-magnon entanglement and its quantification via a microwave cavity
Part of Physical Review B, 2021
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Ultrafast magnetization dynamics in the half-metallic Heusler alloy Co2FeAl
Part of Physical Review B, 2021
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Part of Journal of Materials Science & Technology, p. 15-20, 2021
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Part of Journal of Applied Physics, 2020
- DOI for Partial cation ordering, relaxor ferroelectricity, and ferrimagnetism in Pb(Fe1-xYbx)(2/3)W1/3O3 solid solutions
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Part of Physica Status Solidi (B), 2020
- DOI for Soft X-Ray Magnetic Circular Dichroism of Vanadium in the Metal-Insulator Two-Phase Region of Paramagnetic V2O3 Doped with 1.1% Chromium
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Measuring the Intra-Atomic Exchange Energy in Rare-Earth Adatoms
Part of Physical Review X, 2020
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Pressure effect on the order-disorder transformation in L1(0) FeNi
Part of Scientific Reports, 2020
- DOI for Pressure effect on the order-disorder transformation in L1(0) FeNi
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First-principles Dzyaloshinskii-Moriya interaction in a non-collinear framework
Part of Scientific Reports, 2020
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Localized surface electromagnetic waves in CrI3-based magnetophotonic structures
Part of Optics Express, p. 29155-29165, 2020
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Part of Applied Physics Reviews, 2020
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Multiscale approach for magnetization dynamics: unraveling exotic magnetic states of matter
Part of Physical Review Research, 2020
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Part of Physical Review Research, 2020
- DOI for Analysis of the linear relationship between asymmetry and magnetic moment at the M edge of 3d transition metals
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Hierarchy of magnon mode entanglement in antiferromagnets
Part of Physical Review B Condensed Matter, 2020
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Equation of motion and the constraining field in ab initio spin dynamics
Part of Physical Review B, 2020
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Local structure in amorphous SmxCo1-x: a combined experimental and theoretical study
Part of Journal of Materials Science, p. 12488-12498, 2020
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Magnetic two-dimensional electron liquid at the surface of Heusler semiconductors
Part of Physical Review Materials, 2020
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Part of Physical Review Letters, 2020
- DOI for Coexistence of Superconductivity and Charge Density Waves in Tantalum Disulfide: Experiment and Theory
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Chemical ordering controlled thermo-elasticity of AlTiVCr1-xNbx high-entropy alloys
Part of Acta Materialia, p. 53-62, 2020
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Interlayer Charge Transfer in Tin Disulphide: Orbital Anisotropy and Temporal Aspects
Part of Physical Review B, 2020
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Localized versus itinerant character of 4f-states in cerium oxides
Part of Journal of Physics, 2020
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High-throughput and data-mining approach to predict new rare-earth free permanent magnets
Part of Physical Review B, 2020
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Self-induced spin glass state in elemental and crystalline neodymium
Part of Science, 2020
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Oxygen vacancy in ZnO-w phase: pseudohybrid Hubbard density functional study
Part of Journal of Physics, 2020
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Part of Science Advances, 2020
- DOI for Direct light-induced spin transfer between different elements in a spintronic Heusler material via femtosecond laser excitation
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Giant anisotropy of Gilbert damping in a Rashba honeycomb antiferromagnet
Part of Physical Review B, 2020
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Part of Physical Review B, 2020
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Nonreciprocal spin pumping damping in asymmetric magnetic trilayers
Part of Physical Review B, 2020
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Part of European Physical Journal B, 2019
- DOI for Cation ordering, ferrimagnetism and ferroelectric relaxor behavior in Pb(Fe1-xScx)(2/3)W1/3O3 solid solutions
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Part of The Journal of Physical Chemistry Letters, p. 911-917, 2019
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Density Functional Theory description of the order-disorder transformation in Fe-Ni
Part of Scientific Reports, 2019
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Multi-polaron solutions, nonlocal effects and internal modes in a nonlinear chain
Part of Journal of physics: Condensed matter, 2019
- DOI for Multi-polaron solutions, nonlocal effects and internal modes in a nonlinear chain
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General method for atomistic spin-lattice dynamics with first-principles accuracy
Part of Physical Review B, 2019
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Influence of antiphase boundary of the MnAl tau-phase on the energy product
Part of Physical Review Materials, 2019
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Intrinsic magnetic properties of SmFe12-xVx alloys with reduced V-concentration
Part of Journal of Alloys and Compounds, p. 969-974, 2019
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Tuning the magnetocrystalline anisotropy of Fe3Sn by alloying
Part of Physical Review B, 2019
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Database of novel magnetic materials for high-performance permanent magnet development
Part of Computational materials science, p. 188-202, 2019
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Part of Physical Review B, 2019
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Spin polaronics: Static and dynamic properties of spin polarons in La-doped CaMnO4
Part of Physical Review B, 2019
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Photoelectron Spectroscopy of Molecules Beyond the Electric Dipole Approximation
Part of Journal of Chemical Theory and Computation, p. 5483-5494, 2019
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Peculiar magnetic states in the double perovskite Nd2NiMnO6
Part of Physical Review B, 2019
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Ligand effects on the linear response Hubbard U: The case of transition metal phthalocyanines
Part of Journal of Physical Chemistry A, p. 3214-3222, 2019
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Part of Physical Review B, 2019
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Atomic photoionization cross sections beyond the electric dipole approximation
Part of Journal of Chemical Physics, 2019
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Self-organizing maps as a method for detecting phase transitions and phase identification
Part of Physical Review B, 2019
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Another view on Gilbert damping in two-dimensional ferromagnets
Part of Scientific Reports, 2018
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Investigation of the spectral properties and magnetism of BiFeO3 by dynamical mean-field theory
Part of Physical Review B, 2018
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Part of Physical Review Materials, 2018
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Nonlocal Gilbert damping tensor within the torque-torque correlation model
Part of Physical Review Materials, 2018
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Part of Journal of Materials Chemistry C, p. 12689-12697, 2018
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Part of Physical Review B, 2018
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Part of Physical Chemistry, Chemical Physics - PCCP, p. 22168-22178, 2018
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A majority gate with chiral magnetic solitons
Part of Journal of Physics, 2018
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Magnetic anisotropy in permalloy: hidden quantum mechanical features
Part of Physical Review B, 2018
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Superconductivity in two-dimensional phosphorus carbide (β(o)-PC)
Part of Physical Chemistry, Chemical Physics - PCCP, p. 12362-12367, 2018
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Searching for materials with reduced dimension
Part of Nature Nanotechnology, p. 180-181, 2018
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Suppression of the Verwey Transition by Charge Trapping
Part of Annalen der Physik, 2018
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Mapping the magnetic transition temperatures for medium- and high-entropy alloys
Part of Intermetallics (Barking), p. 80-84, 2018
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Part of Physical Review B, 2018
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Coupling atomistic and continuum modelling of magnetism
Part of Computer Methods in Applied Mechanics and Engineering, p. 219-253, 2018
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The Bethe-Slater curve revisited; new insights from electronic structure theory
Part of Scientific Reports, 2017
- DOI for The Bethe-Slater curve revisited; new insights from electronic structure theory
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Magnetic moment of inertia within the torque-torque correlation model
Part of Scientific Reports, 2017
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Towards sub-nanometer real-space observation of spin and orbital magnetism at the Fe/MgO interface
Part of Scientific Reports, 2017
- DOI for Towards sub-nanometer real-space observation of spin and orbital magnetism at the Fe/MgO interface
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Magnetic properties of the Fe5SiB2−Fe5PB2 system
Part of Physical Review B, 2017
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Prediction of the new efficient permanent magnet SmCoNiFe3
Part of Physical Review B, 2017
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Part of Physical Review Materials, 2017
- DOI for Combining electronic structure and many-body theory with large databases: A method for predicting the nature of 4 f states in Ce compounds
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Theory of L-edge spectroscopy of strongly correlated systems
Part of Physical Review B, 2017
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Exchange interactions of CaMnO3 in the bulk and at the surface
Part of Physical Review B Condensed Matter, 2017
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Theory of noncollinear interactions beyond Heisenberg exchange: Applications to bcc Fe
Part of Physical Review B, 2017
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Magnetism and ultrafast magnetization dynamics of Co and CoMn alloys at finite temperature
Part of Physical review B, 2017
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Topological edge-state engineering with high-frequency electromagnetic radiation
Part of Physical Review B, 2017
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Spin-polaron formation and magnetic state diagram in La-doped CaMnO3
Part of Physical Review B, 2017
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Part of Physical Review B, 2017
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On the origin of perpendicular magnetic anisotropy in strained Fe-Co(-X) films
Part of Journal of Physics D, 2017
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First-principles theory of electronic structure and magnetism of Cr nano-islands on Pd(111)
Part of Journal of Physics, 2017
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Evolution of the structural and multiferroic properties of PbFe2/3W1/3O3 ceramics upon Mn-doping
Part of Materials Chemistry and Physics, p. 218-232, 2017
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On the phase stability of CaCu5-type compounds
Part of Journal of Alloys and Compounds, p. 549-554, 2017
- DOI for On the phase stability of CaCu5-type compounds
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Enhanced spin–orbit coupling in tetragonally strained Fe–Co–B films
Part of Journal of Physics, 2017
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AlM2B2 (M =Cr, Mn, Fe, Co, Ni): a group of nanolaminated materials
Part of Journal of Physics, 2017
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Mapping of Defects in Individual Silicon Nanocrystals Using Real-Space Spectroscopy.
Part of The Journal of Physical Chemistry Letters, p. 1047-1054, 2016
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A spin dynamics approach to solitonics
Part of Scientific Reports, 2016
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Site-selective local fluorination of graphene induced by focused ion beam irradiation
Part of Scientific Reports, 2016
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Magnetism and exchange interaction of small rare-earth clusters: Tb as a representative
Part of Scientific Reports, 2016
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Magnetic properties of Fe5SiB2 and its alloys with P, S, and Co
Part of PHYSICAL REVIEW B, 2016
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High photon energy spectroscopy of NiO: Experiment and theory
Part of PHYSICAL REVIEW B, 2016
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Correlated electronic structure of CeN
Part of Journal of Electron Spectroscopy and Related Phenomena, p. 111-115, 2016
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Analytic continuation by averaging Pade approximants
Part of PHYSICAL REVIEW B, 2016
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Part of Physical Review B. Condensed Matter and Materials Physics, 2016
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Microscopic Origin of Heisenberg and Non-Heisenberg Exchange Interactions in Ferromagnetic bcc Fe
Part of Physical Review Letters, 2016
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Magnetic and electronic structure of Mn nanostructures on Ag(111) and Au(111)
Part of PHYSICAL REVIEW B, 2016
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Polar Order and Frustrated Antiferromagnetism in Perovskite Pb2MnWO6 Single Crystals.
Part of Inorganic Chemistry, p. 2791-2805, 2016
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Low temperature magneto-structural transitions in Mn3Ni20P6
Part of Journal of Solid State Chemistry, p. 343-348, 2016
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Reproducibility in density functional theory calculations of solids.
Part of Science, p. 1415-1422, 2016
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A new 2D monolayer BiXene, M2C (M = Mo, Tc, Os)
Part of Nanoscale, p. 15753-15762, 2016
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Many-body effects and excitonic features in 2D biphenylene carbon
Part of Journal of Chemical Physics, 2016
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Scale transitions in magnetisation dynamics
Part of Communications in Computational Physics, p. 969-988, 2016
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Ultra-low magnetic damping of a metallic ferromagnet
Part of Nature Physics, p. 839-842, 2016
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Part of Journal of Chemical Physics, 2016
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Ab initio investigation of competing antiferromagnetic structures in low Si-content FeMn(PSi) alloy
Part of Journal of Physics, 2016
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Finite-temperature interatomic exchange and magnon softening in Fe overlayers on Ir(001)
Part of PHYSICAL REVIEW B, 2016
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Part of PHYSICAL REVIEW B, 2016
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Part of Journal of Chemical Theory and Computation, p. 1772-1785, 2016
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Standard model of the rare earths analyzed from the Hubbard I approximation
Part of PHYSICAL REVIEW B, 2016
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Electronic structure and exchange interactions of insulating double perovskite La2CuRuO6
Part of PHYSICAL REVIEW B, 2016
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Correlation effects and orbital magnetism of Co clusters
Part of PHYSICAL REVIEW B, 2016
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First-principles investigation of two-dimensional trichalcogenide and sesquichalcogenide monolayers
Part of PHYSICAL REVIEW B, 2016
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Part of PHYSICAL REVIEW B, 2016
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Amorphous W-S-N thin films: the atomic structure behind ultra-low friction
Part of Acta Materialia, p. 84-93, 2015
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Two-Dimensional Indium Selenides Compounds: An Ab Initio Study
Part of The Journal of Physical Chemistry Letters, p. 3098-3103, 2015
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Part of Scientific Reports, 2015
- DOI for First-principles study of the influence of different interfaces and core types on the properties of CdSe/CdS core-shell nanocrystals
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Part of Scientific Reports, 2015
- DOI for Effect of uniaxial strain on the site occupancy of hydrogen in vanadium from density-functional calculations
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Part of The Journal of Physical Chemistry C, p. 21227-21233, 2015
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Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Polaron mobility in oxygen-deficient and lithium-doped tungsten trioxide
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
- DOI for Polaron mobility in oxygen-deficient and lithium-doped tungsten trioxide
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Amorphous W-S-N thin films: The atomic structure behind ultra-low friction
Part of Acta Materialia, p. 84-93, 2015
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Lattice dynamics and chemical bonding in Sb2Te3 from first-principles calculations
Part of Journal of Chemical Physics, 2015
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Part of Physical Review B. Condensed Matter and Materials Physics, 2015
- DOI for Layer-resolved magnetic exchange interactions of surfaces of late 3d elements: Effects of electronic correlations
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Valence and spectral properties of rare-earth clusters
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Dynamics of quasiparticles in graphene under intense circularly polarized light
Part of Physical Review B Condensed Matter, 2015
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Part of Journal of Chemical Physics, 2015
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Part of Journal of Chemical Physics, 2015
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Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 165429-165435, 2015
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Part of Journal of Chemical Physics, 2015
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Part of JOM, p. 1318-1328, 2015
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Universal distribution of magnetic anisotropy of impurities in ordered and disordered nanograins
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Quasi-2D Cu2S Crystals on Graphene: In-situ Growth and ab-initio Calculations
Part of Small, p. 1253-1257, 2015
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Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Magnetic properties of (Fe1-xCox)(2)B alloys and the effect of doping by 5d elements
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Electronic topological transition and noncollinear magnetism in compressed hcp Co
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Gilbert-like damping caused by time retardation in atomistic magnetization dynamics
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Monovacancy formation energies and Fermi surface topological transitions in Pd-Ag alloys
Part of Physical Review B. Condensed Matter and Materials Physics, 2015
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Part of Journal of Applied Physics, 2015
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Part of Journal of Materials Research, p. 207-214, 2014
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A charge self-consistent LDA plus DMFT study of the spectral properties of hexagonal NiS
Part of New Journal of Physics, 2014
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Topological excitations in a kagome magnet
Part of Nature Communications, p. 4815, 2014
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The dipole moment of the spin density as a local indicator for phase transitions
Part of Scientific Reports, p. 5760, 2014
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Effect of spin orbit coupling and Hubbard U on the electronic structure of IrO2
Part of Physical Review B. Condensed Matter and Materials Physics, p. 155102, 2014
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Thermally driven domain-wall motion in Fe on W(110)
Part of Physical Review B. Condensed Matter and Materials Physics, 2014
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Hole bipolaron formation at (100) MgO/CaO epitaxial interface
Part of Physical Review B. Condensed Matter and Materials Physics, p. 125118, 2014
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Elucidating the 3d Electronic Configuration in Manganese Phthalocyanine
Part of Journal of Physical Chemistry A, p. 927-932, 2014
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Field-regulated switching of the magnetization of Co-porphyrin on graphene
Part of Physical Review B. Condensed Matter and Materials Physics, p. 144411, 2014
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Tuning order-by-disorder multiferroicity in CuO by doping
Part of Physical Review B. Condensed Matter and Materials Physics, 2014
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Anisotropy of magnetic properties of Fe1+y Te
Part of Journal of Physics, p. 436003, 2014
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Electronic structure, cohesive properties, and magnetism of SrRuO3
Part of Physical Review B. Condensed Matter and Materials Physics, p. 165130, 2014
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Fe phthalocyanine on Co(001): Influence of surface oxidation on structural and electronic properties
Part of Physical Review B. Condensed Matter and Materials Physics, 2014
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Part of Physical Review B. Condensed Matter and Materials Physics, 2014
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Fermi Condensation Near van Hove Singularities Within the Hubbard Model on the Triangular Lattice
Part of Physical Review Letters, 2014
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 205311, 2014
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 224105, 2014
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Lattice dynamics of cubic AuZn from first principles
Part of Physical Review B. Condensed Matter and Materials Physics, p. 104101, 2014
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Treatment of 4 f states of the rare earths: The case study of TbN
Part of Physical Review B. Condensed Matter and Materials Physics, p. 205109, 2014
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Revisiting the adsorption of copper-phthalocyanine on Au(111) including van der Waals corrections
Part of Journal of Chemical Physics, p. 124711, 2014
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 144403, 2014
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 205411, 2014
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Magnetic properties of FexCo1-x nanochains on Pt(111) surfaces
Part of Journal of Physics, p. 206003, 2014
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Origin of the magnetostructural coupling in FeMnP0.75Si0.25
Part of Physical Review B. Condensed Matter and Materials Physics, p. 214436, 2014
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Kinetic arrest induced antiferromagnetic order in hexagonal FeMnP0.75Si0.25 alloy
Part of Applied Physics Letters, p. 262405, 2014
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Electronic structure of In3Se4 and In3Te4 monolayers from ab-initio calculations
Part of Annalen der Physik, p. 402-407, 2014
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Tribochemically Active Ti–C–S Nanocomposite Coatings
Part of Materials Research Letters, p. 148-155, 2013
- DOI for Tribochemically Active Ti–C–S Nanocomposite Coatings
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Two-Dimensional Materials from Data Filtering and Ab Initio Calculations
Part of Physical Review X, 2013
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Part of Nature Communications, p. 2645, 2013
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Complex magnetic structure of clusters and chains of Ni and Fe on Pt(111)
Part of Scientific Reports, p. 3054, 2013
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Defect controlled magnetism in FeP/graphene/Ni(111)
Part of Scientific Reports, p. 3405, 2013
- DOI for Defect controlled magnetism in FeP/graphene/Ni(111)
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Part of Computational materials science, p. 282-286, 2013
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Designing Fe Nanostructures at Graphene/h-BN Interfaces
Part of The Journal of Physical Chemistry C, p. 21763-21771, 2013
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Part of The Journal of Physical Chemistry C, p. 7018-7025, 2013
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Iron porphyrin molecules on Cu(001): Influence of adlayers and ligands on the magnetic properties
Part of Physical Review B. Condensed Matter and Materials Physics, p. 174425, 2013
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Effects of strain on ferroelectric polarization and magnetism in orthorhombic HoMnO3
Part of Physical Review B. Condensed Matter and Materials Physics, 2013
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Correlated electronic structure of Fe in bulk Cs and on a Cs surface
Part of Physical Review B. Condensed Matter and Materials Physics, p. 115142, 2013
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X-ray absorption spectra: Graphene, h-BN, and their alloy
Part of Physical Review B. Condensed Matter and Materials Physics, p. 155108, 2013
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Manipulation of spin state of iron porphyrin by chemisorption on magnetic substrates
Part of Physical Review B. Condensed Matter and Materials Physics, 2013
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Transition between direct and indirect band gap in silicon nanocrystals
Part of Physical Review B. Condensed Matter and Materials Physics, p. 245401, 2013
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Experimental and theoretical study of electronic structure of lutetium bi-phthalocyanine
Part of Journal of Chemical Physics, p. 234701, 2013
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Hydrogen storage properties of the pseudo binary Laves phase (Sc1-xZrx)(Co1-yNiy)2 system
Part of International journal of hydrogen energy, p. 9772-9778, 2013
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Electronic structure and magnetic properties of Mn, Co, and Ni substitution of Fe in Fe4N
Part of Physical Review B. Condensed Matter and Materials Physics, 2013
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Identifying the Electronic Character and Role of the Mn States in the Valence Band of (Ga,Mn)As
Part of Physical Review Letters, 2013
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Phonon spectrum, thermodynamic properties, and pressure-temperature phase diagram of uranium dioxide
Part of Physical Review B. Condensed Matter and Materials Physics, p. 104107, 2013
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Interatomic Exchange Interactions for Finite-Temperature Magnetism and Nonequilibrium Spin Dynamics
Part of Physical Review Letters, p. 127204, 2013
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Atomistic spin dynamics of low-dimensional magnets
Part of Physical Review B Condensed Matter, 2013
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Oxygen-tuned magnetic coupling of Fe-phthalocyanine molecules to ferromagnetic Co films
Part of Physical Review B. Condensed Matter and Materials Physics, p. 224424, 2013
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Part of Physical Review X, 2012
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Formation and Structure of Graphene Waves on Fe(110)
Part of Physical Review Letters, 2012
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Magnetic ordering in Ni-rich NiMn alloys around the multicritical point: Experiment and theory
Part of Physical Review B. Condensed Matter and Materials Physics, p. 174405, 2012
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Electronic entanglement in late transition metal oxides
Part of Physical Review Letters, p. 186401, 2012
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Ultrafast Spin Dynamics in Multisublattice Magnets
Part of Physical Review Letters, 2012
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Improved gas sensing activity in structurally defected bilayer graphene
Part of Nanotechnology, p. 50550, 2012
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 205109, 2012
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Part of Philosophical Magazine, p. 888-898, 2012
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High-temperature phonon stabilization of γ-uranium from relativistic first-principles theory
Part of Physical Review B. Condensed Matter and Materials Physics, 2012
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Functionalization of edge reconstructed graphene nanoribbons by H and Fe: A density functional study
Part of Solid State Communications, p. 1719-1724, 2012
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Part of Journal of Materials Chemistry, p. 14741-14745, 2012
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Magnetic exchange interactions in B-, Si-, and As-doped Fe2P from first-principles theory
Part of Physical Review B. Condensed Matter and Materials Physics, p. 224435, 2012
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Part of Journal of Physics, p. 295901, 2012
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Structural properties of amorphous metal carbides: Theory and experiment
Part of Acta Materialia, p. 4720-4728, 2012
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Large magnetic anisotropy of Fe2P investigated via ab initio density functional theory calculations
Part of Physical Review B. Condensed Matter and Materials Physics, 2012
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Part of Physica. B, Condensed matter, p. 4615-4621, 2012
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Microscopic Model for Ultrafast Remagnetization Dynamics
Part of Physical Review Letters, p. 157201, 2012
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Microscopic theory of magnetism in the magnetocaloric material Fe2P1-xTx (T = B and Si)
Part of Physical Review B. Condensed Matter and Materials Physics, 2012
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Correlated electronic structure and chemical bonding of cerium pnictides and γ-Ce
Part of Physical Review B. Condensed Matter and Materials Physics, p. 115116, 2012
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Ferrimagnetism, antiferromagnetism, and magnetic frustration in La2-xSrxCuRuO6 (0 <= x <= 1)
Part of Physical Review B. Condensed Matter and Materials Physics, 2012
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Part of Computational materials science, p. 295-302, 2012
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Accelerating the switching of magnetic nanoclusters by anisotropy-driven magnetization dynamics
Part of Physical Review B. Condensed Matter and Materials Physics, p. 224401, 2012
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Part of Science and Technology of Atomic, Molecular, Condensed Matter and Biological Systems, 2012
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Carbon Release by Selective Alloying of Transition Metal Carbides
Part of Journal of Physics, p. 355401-+, 2011
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Fe3.3Ni83.2Mo13.5: a likely candidate to show spin-glass behaviour at low temperatures
Part of Journal of Physics, p. 106002, 2011
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Suppression of Standing Spin Waves in Low-Dimensional Ferromagnets
Part of Physical Review Letters, 2011
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 125424, 2011
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Part of Physical Review B. Condensed Matter and Materials Physics, 2011
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Ultrafast switching in a synthetic antiferromagnetic magnetic random-access memory device
Part of Physical Review B. Condensed Matter and Materials Physics, p. 224429, 2011
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Order–disorder induced magnetic structures of FeMnP0.75Si0.25
Part of Physical Review B. Condensed Matter and Materials Physics, 2011
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 132402, 2011
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Local electronic structure information contained in energy-filtered diffraction patterns
Part of Physical Review B. Condensed Matter and Materials Physics, 2011
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Experimental and theoretical studies on stainless steel transfer onto a TiN-coated cutting tool
Part of Acta Materialia, p. 68-74, 2011
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Design of carbide-based nanocomposite thin films by selective alloying
Part of Surface & Coatings Technology, p. 583-590, 2011
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Small gold clusters on graphene, their mobility and clustering: a DFT study
Part of Physical Review B Condensed Matter, p. 205301, 2011
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Adsorption of Cu, Ag, and Au atoms on graphene including van der Waals interactions
Part of Journal of Physics, 2011
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Magnetocrystalline anisotropy and uniaxiality of MnAs/GaAs(100) films
Part of Physical Review B. Condensed Matter and Materials Physics, 2011
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Textured growth of the high moment material Gd(0001)/Cr(001)/Fe(001)
Part of Journal of Physics D, p. 265004, 2011
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Ab initio Phonons in Magnetic Ni2MnAl
Part of Japanese Journal of Applied Physics, 2011
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Part of Journal of Chemical Physics, 2011
- DOI for Valence-band electronic structure of iron phthalocyanine: An experimental and theoretical photoelectron spectroscopy study
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From collinear to vortex magnetic structures in Mn corrals on Pt(111)
Part of Physical Review B. Condensed Matter and Materials Physics, 2011
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Thermo-physical properties of body-centered cubic iron-magnesium alloys under extreme conditions
Part of Solid State Communications, p. 203-207, 2011
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Tuning of dielectric properties and magnetism of SrTiO3 by site-specific doping of Mn
Part of Physical Review B. Condensed Matter and Materials Physics, p. 125124, 2011
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Graphene as a Reversible Spin Manipulator of Molecular Magnets
Part of Physical Review Letters, p. 257202, 2011
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Lattice dynamics and elastic properties of the 4 f electron system: CeN
Part of Physical Review B. Condensed Matter and Materials Physics, p. 205135, 2011
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Disorder-induced metallicity in amorphous graphene
Part of Physical Review B. Condensed Matter and Materials Physics, p. 205414, 2011
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Strongly enhanced magnetic moments in ferromagnetic FeMnP0.5Si0.5
Part of Applied Physics Letters, p. 152502, 2011
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Part of Physical Review B. Condensed Matter and Materials Physics, 2011
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Part of Europhysics letters, p. 66006, 2011
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Design of the Lattice Parameter of Embedded Nanoparticles
Part of Chemical Physics Letters, p. 95-99, 2010
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Wear-resistant magnetic thin film material based on a Ti1−xFexC1−y nanocomposite alloy
Part of Physical Review B Condensed Matter, 2010
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Magnon softening in a ferromagnetic monolayer: A first-principles spin dynamics study
Part of Physical Review B. Condensed Matter and Materials Physics, p. 144416, 2010
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Dynamical effects in x-ray absorption spectra of graphene and monolayered h-BN on Ni(111)
Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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Defect-controlled electronic transport in single, bilayer, and N-doped graphene: Theory
Part of Physical Review B. Condensed Matter and Materials Physics, p. 245405, 2010
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Conductivity engineering of graphene by defect formation
Part of Journal of Physics D, 2010
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Reciprocal and real space maps for EMCD experiments
Part of Ultramicroscopy, p. 1380-1389, 2010
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Quantitative magnetic measurements with transmission electron microscope
Part of Journal of Magnetism and Magnetic Materials, p. 1478-1480, 2010
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 104414, 2010
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Theoretical studies of the incommensurate magnetic structure of a heavy fermion system: CeRhIn5
Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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Density functional study of the electronic structure and lattice dynamics of SrCl2
Part of Journal of Physics, p. 445402, 2010
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Simulation of hydrogenated graphene field-effect transistors through a multiscale approach
Part of Physical Review B. Condensed Matter and Materials Physics, p. 153404, 2010
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Complex edge effects in zigzag graphene nanoribbons due to hydrogen loading
Part of Physical Review B. Condensed Matter and Materials Physics, p. 165405, 2010
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Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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Highly anisotropic sliding at TiN/Fe interfaces: A first principles study
Part of Journal of Applied Physics, p. 113511, 2010
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Ab initio study of structural and magnetic properties of Si-doped Fe2P
Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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First-principles theory of dilute magnetic semiconductors
Part of Reviews of Modern Physics, p. 1633-1690, 2010
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Dynamical stability of body center cubic iron at the Earth's core conditions
Part of Proceedings of the National Academy of Sciences of the United States of America, p. 9962-9964, 2010
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Forcing Ferromagnetic Coupling Between Rare-Earth-Metal and 3d Ferromagnetic Films
Part of Physical Review Letters, p. 156402, 2010
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Part of Advanced Materials, p. 1626-1630, 2010
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Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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Theory of spin-polarized scanning tunneling microscopy applied to local spins
Part of Physical Review B. Condensed Matter and Materials Physics, p. 115454, 2010
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Electronic structure of Co-phthalocyanine calculated by GGA plus U and hybrid functional methods
Part of Chemical Physics, p. 96-99, 2010
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Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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Part of Physical Review Letters, p. 117601, 2010
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Part of Physical Review B. Condensed Matter and Materials Physics, 2010
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A new material for hydrogen storage; ScAl0.8Mg0.2
Part of Journal of Solid State Chemistry, p. 3113-3117, 2009
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Simulation of a spin-wave instability from atomistic spin dynamics
Part of Physical Review B Condensed Matter, p. 184426, 2009
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Competing anisotropies in bcc Fe81Ni19/Co(001) superlattices
Part of Applied Physics Letters, 2009
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Atomistic spin dynamics of the Cu-Mn spin-glass alloy
Part of Physical Review B Condensed Matter, 2009
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Quantitative magnetic information from reciprocal space maps in transmission electron microscopy
Part of Physical Review Letters, 2009
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Exchange coupling and exchange bias in FM/AFM bilayers for a fully compensated AFM interface
Part of Acta Physica Polonica. A, p. 25-29, 2009
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Part of Computational materials science, p. 1042-1049, 2009
- DOI for Data mining and accelerated electronic structure theory as a tool in the search for new functional materials
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gamma-Mn at the border between weak and strong correlations
Part of European Physical Journal B, p. 473-478, 2009
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Microscopic picture of Co clustering in ZnO
Part of Physical Review B. Condensed Matter and Materials Physics, p. 125202, 2009
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Molecular adsorption in defected graphene with divacancy defects
Part of Physical Review B. Condensed Matter and Materials Physics, p. 113409, 2009
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Part of Journal of Physics, p. 175402, 2009
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Evolving properties of two-dimensional materials: from graphene to graphite
Part of Journal of Physics, p. 335502, 2009
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Accurate electronic band gap of pure and functionalized graphane from GW calculations
Part of Physical Review B. Condensed Matter and Materials Physics, p. 245117, 2009
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Magnetism-driven anomalous surface alloying between Cu and Cr
Part of Applied Physics Letters, p. 172507, 2009
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Multiplet effects in the electronic structure of intermediate-valence compounds
Part of Physical Review B. Condensed Matter and Materials Physics, p. 165104, 2009
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Theory of He trapping, diffusion, and clustering in UO2
Part of Journal of Nuclear Materials, p. 510-516, 2009
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First-principles modeling of He-clusters in UO2
Part of Journal of Nuclear Materials, p. 72-74, 2009
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Tailoring the Nature of Magnetic Coupling of Fe-Porphyrin Molecules to Ferromagnetic Substrates
Part of Physical Review Letters, 2009
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The self-consistent ab initio lattice dynamical method
Part of Computational materials science, p. 888-894, 2009
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Strength of Correlation Effects in the Electronic Structure of Iron
Part of Physical Review Letters, p. 267203, 2009
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First-principles theory for helium and xenon diffusion in uranium dioxide
Part of Journal of Nuclear Materials, p. 364-367, 2009
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Electronic structure and bulk properties of MB6 and MB12 borides
Part of Low Temperature Physics, p. 921-929, 2008
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Increasing the equilibrium solubility of dopants in semiconductor multilayers and alloys
Part of Physical Review Letters, p. 105501, 2008
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Part of Physical Review B. Condensed Matter and Materials Physics, 2008
- DOI for Anisotropy in the electronic structure of V2GeC investigated by soft x-ray emission spectroscopy and first-principles theory
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Part of Physical Review B. Condensed Matter and Materials Physics, 2008
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Part of Journal of Physics D, 2008
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Part of Physical Review B. Condensed Matter and Materials Physics, 2008
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Cobalt-doped beta-peptide nanotubes: A class of spintronic materials
Part of Physical Review B. Condensed Matter and Materials Physics, p. 155407, 2008
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Magnetism of Co overlayers and nanostructures on W(001): A first principles study
Part of Journal of Magnetism and Magnetic Materials, p. 1173-1179, 2008
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Spin and orbital moments of Fe clusters supported on Ni(001)
Part of Journal of Physics, 2008
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Part of Physical Review Letters, 2008
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Role of magnetic impurities in Fe/V multilayers
Part of Physical Review B. Condensed Matter and Materials Physics, p. 144408, 2008
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A method for atomistic spin dynamics simulations: implementation and examples
Part of Journal of Physics, p. 315203, 2008
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Inhomogeneity in Co Doped ZnO Diluted Magnetic Semiconductor
Part of Journal of Applied Physics, 2008
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Dynamics of diluted magnetic semiconductors from atomistic spin-dynamics simulations: Mn-doped GaAs
Part of Physical Review B. Condensed Matter and Materials Physics, p. 144419, 2008
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Noncollinear magnetism in the high-pressure hcp phase of iron
Part of Physical Review B. Condensed Matter and Materials Physics, 2008
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 245101, 2008
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Part of Physical Review B. Condensed Matter and Materials Physics, 2008
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Part of Physical Review B. Condensed Matter and Materials Physics, 2008
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Magnetic-instability-induced giant magnetoelectric coupling
Part of Advanced Materials, p. 1353-+, 2008
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Volume dependent magnetism in zinc-blende MnX (X=N,P,As,Sb,Bi) compounds
Part of Journal of Applied Physics, 2008
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Part of Physica. B, Condensed matter, p. 4111-4119, 2008
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Spin and orbital moment sum-rules for the electron energy loss chiral magnetic dichroism
Part of Physica. B, Condensed matter, p. 1614-1615, 2008
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Electronic structure of Co doped ZnO: Theory and experiment
Part of Journal of Applied Physics, 2008
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Ab initio calculations of the phonon spectra and the thermal expansion coefficients of the 4d metals
Part of Physical Review B. Condensed Matter and Materials Physics, 2008
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Role of defects on the magnetic interactions in Mn-doped ZnO
Part of Physica Status Solidi (A), p. 53-60, 2007
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Ab-initio modeling of spintronic materials
Part of Physica Status Solidi (A), p. 33-43, 2007
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Part of Physical Review Letters, p. 177207, 2007
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Design of Nanocomposite Low-Friction Coatings
Part of Advanced Functional Materials, p. 1611-1616, 2007
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Bonding mechanism in the nitrides Ti2AlN and TiN: An experimental and theoretical investigation
Part of Physical Review B. Condensed Matter and Materials Physics, 2007
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Anomalous Thermal Expansion in α-Titanium
Part of Physical Review Letters, 2007
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Dimensionality crossover in the induced magnetization of Pd layers
Part of Journal of Physics, p. 246213, 2007
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Part of Journal of Physics, p. 156226, 2007
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Quasiparticle and optical properties of BeH2
Part of Journal of Physics, 2007
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Influence of defects on the magnetism of Mn-doped ZnO
Part of Journal of Applied Physics, 2007
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Noncollinear spin states in TlCo2Se2-xSx alloys from first principles
Part of Physical Review B. Condensed Matter and Materials Physics, 2007
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Effect of diffusion and alloying on the magnetic and transport properties of Fe/V/Fe trilayers
Part of Physical Review B. Condensed Matter and Materials Physics, 2007
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Prediction of MAX phases, VN+1SiCN (N=1,2), from first-principles theory
Part of Journal of Applied Physics, 2007
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Substrate-induced magnetic ordering and switching of iron porphyrin molecules
Part of Nature Materials, p. 516-520, 2007
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 224425, 2007
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Theory of bulk and surface quasiparticle spectra for Fe, Co, and Ni
Part of Physical Review B. Condensed Matter and Materials Physics, 2007
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Fermiology of PuCoGa5 and of related Pu-115 compounds
Part of Journal of Alloys and Compounds, p. 109-113, 2007
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Sum rules for electron energy loss near edge spectra
Part of Physical Review B. Condensed Matter and Materials Physics, 2007
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Ordering in diluted magnetic semiconductors: A magnetic percolation phenomenon (invited)
Part of Journal of Applied Physics, 2007
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Electronic structure, bulk and magnetic properties of MB6 and MB12 borides
Part of Journal of Alloys and Compounds, p. 228-230, 2007
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Part of Physical Review B. Condensed Matter and Materials Physics, p. 161402, 2007
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Magnetic interactions of Mn clusters supported on Cu
Part of Physical Review B, 2006
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Part of Europhysics letters, p. 170-171, 2006
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Dual nature of the 5f electrons in plutonium materials
Part of PHYSICA B-CONDENSED MATTER, p. 920, 2006
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Electronic spectra and magnetic properties of RB6, RB12 and RB2C2 borides
Part of Physica Status Solidi (C), p. 229-232, 2006
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Multiplet effects in the electronic structure of heavy rare-earth metals
Part of Journal of Physics, p. 6329-6335, 2006
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Ab initio study of the electronic properties and Fermi surface of the uranium dipnictides
Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Electronic structure and magnetic properties of RNi5-xCux alloys (R=Y, La, Ce)
Part of Low Temperature Physics, p. 1140-1146, 2006
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Calculation of the equation of state of fcc Au from first principles
Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Part of Physical Review B. Condensed Matter and Materials Physics, 2006
- DOI for Electronic structure and chemical bonding in Ti4SiC3 investigated by soft x-ray emission spectroscopy and first-principles theory
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Electronic structure and chemical bonding in Ti2AlC investigated by soft x-ray emission spectroscopy
Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Theory of weakly coupled two-dimensional magnets
Part of Journal of Physics, p. 4853, 2006
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Competing Exchange Interactions in Magnetic Multilayers
Part of Physical Review Letters, 2006
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Perpendicular magnetocrystalline anisotropy in tetragonally distorted Fe-Co alloys
Part of Physical Review Letters, 2006
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Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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General trend of the mechanical properties of the ternary carbides M3SiC2 (M=transition metal)
Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Volume-dependent exchange interactions and noncollinear magnetism in zinc-blende MnAs
Part of Physical Review B. Condensed Matter and Materials Physics, p. 184401, 2006
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Non-collinear magnetisation of V clusters supported on a Cu (111) surface: Theory
Part of Surface Science, p. 4838-4842, 2006
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Experimental and theoretical study of annealed Ni-Pt alloys
Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Magnetic moments of Fe clusters embedded in an Fe-Co alloy
Part of Physical Review B. Condensed Matter and Materials Physics, p. 104422, 2006
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Magnetic properties of Fe/Co(001) superlattices from first-principles theory
Part of Physical Review B. Condensed Matter and Materials Physics, p. 174409, 2006
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Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Theoretical study of the magnetism of Mn-doped ZnO with and without defects
Part of Physical Review B. Condensed Matter and Materials Physics, p. 235208, 2006
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Multiplet effects in the electronic structure of light rare-earth metals
Part of Physical Review B. Condensed Matter and Materials Physics, 2006
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Ferromagnetism in Mn doped half-Heusler NiTiSn: Theory and experiment
Part of Applied Physics Letters, p. 212502, 2006
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Ab initio electronic structure calculations of Pu-115 compounds
Part of J. Phys. Soc. Jpn., 2006
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Magnetic interactions of Mn clusters supported on Cu
Part of PHYSICAL REVIEW B, p. 174434, 2006
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Part of Phys. Rev. B, 2006
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Part of Physical Review B, 2005
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Vanishing Magnetic Interactions in Ferromagnetic Thin Films
Part of PHYSICAL REVIEW LETTERS, 2005
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Phase separation and charge localization in UHV-lithiated anatase TiO2 nanoparticles
Part of Physical Review B, 2005
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Part of International Journal of Quantum Chemistry, p. 1046-1055, 2005
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Part of International Journal of Quantum Chemistry, p. 1019-1045, 2005
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Electronic and optical properties of, α, γ, and β phases of MgH2: a first-principle GW investigation
Part of Journal of Applied Physics, 2005
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Part of Physical Review B, 2005
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Surface segregation of transition metal impurities on the TiC(100) Surface
Part of Surface Science, p. 101-107, 2005
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Electronic structure and spectroscopic properties of thulium monochalcogenides
Part of PHYSICAL REVIEW B, p. 245102, 2005
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Many-body projector orbitals for electronic structure theory of strongly correlated electrons
Part of International Journal of Quantum Chemistry, p. 160-165, 2005
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Polar magneto-optical Kerr effect for low-symmetric ferromagnets
Part of Physical Review B, 2005
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Pressure effect on the Fermi surface and electronic structure of LuGa3 and TmGa3
Part of Low Temperature Physics, p. 313, 2005
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Magnetic properties and disorder effects in diluted magnetic semiconductors
Part of Physical Review B. Condensed Matter and Materials Physics, p. 195210, 2005
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Cycloidal magnetic order in the compound IrMnSi
Part of Physical Review B. Condensed Matter and Materials Physics, p. 174420, 2005
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Theory of the temperature dependence of the easy axis of magnetization in hcp Gd
Part of Physical Review B. Condensed Matter and Materials Physics, 2005
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Magnetic anisotropy of L10 FePt and Fe1-xMnxPt
Part of Physical Review B Condensed Matter, p. 134411, 2005
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Thermodynamics of a two-dimensional Heisenberg ferromagnet with dipolar interaction
Part of Physical Review B Condensed Matter, 2005
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Vanishing Magnetic Interaction in Ferromagnetic Thin Films
Part of Physical Review Letters, p. 4, 2005
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Ab Initio Theory of Dynamical Core-Hole Screening in Graphite from X-Ray Absorption Spectra
Part of Phys. Rev. Lett., p. 167401-167405, 2005
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Structural and magnetic characterization of Mn3IrGe and Mn3Ir(Si1-xGex): experiments and theory
Part of Journal of Solid State Chemistry, p. 4058-4066, 2004
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Crystal structure and magnetic properties of the new phase Mn3IrSi
Part of Journal of Magnetism and Magnetic Materials, p. 823-825, 2004
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Surface energies and work functions of the transition metal carbides
Part of Surface Science, p. 243-254, 2004
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Magnetic percolation in diluted magnetic semiconductors
Part of Physical Review Letters, p. 137202, 2004
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Electronic structure and magnetism of diluted magnetic semiconductors
Part of Journal of Physics, p. 5481, 2004
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Electronic structure and magnetism of diluted magnetic semiconductors and derivatives
Part of Journal of Magnetism and Magnetic Materials, 2004
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Exchange interactions and critical temperatures in diluted magnetic semiconductors
Part of Journal of Physics, p. 5571, 2004
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Crystal and magnetic structure of Mn3IrSi
Part of Physical Review B. Condensed Matter and Materials Physics, 2004
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Conditions for noncollinear instabilities of ferromagnetic materials
Part of Physical Review Letters, p. 107205, 2004
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On the sharpness of the interfaces in metallic multilayers
Part of Proceedings of the National Academy of Sciences of the United States of America, p. 4742-4745, 2004
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Structural and magnetic aspects of multilayer interfaces
Part of Journal of Magnetism and Magnetic Materials, 2004
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Giant Magnetic Anisotropy in Tetragonal FeCo Alloys
Part of Physical Review Letters, 2004
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Layered compound Nb3SiC2 predicted from first-principles theory
Part of Applied Physics Letters, p. 3071-3073, 2004
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Elastic properties of Mg(1-x)AlxB2 from first principles theory
Part of Journal of Physics, p. 5241-5250, 2004
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Phase relations in the Ti3Sn–D system
Part of Journal of Alloys and Compounds, p. 127-131, 2004
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Calculation of uniaxial magnetic anisotropy energy of tetragonal and trigonal Fe, Co, and Ni
Part of Physical Review B Condensed Matter, p. 104426, 2004
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Magnetism of Fe clusters embedded in a Co matrix from first-principles theory
Part of Physical Review B. Condensed Matter and Materials Physics, p. 174446, 2004
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On the magnetic structure of TlCo2Se2
Part of Journal of Magnetism and Magnetic Materials, p. 272-276, 2004
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Theoretical and experimental study of the magnetic structure of TlCo2Se2
Part of Physical Review B. Condensed Matter and Materials Physics, 2004
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First-principles prediction of superplastic transition-metal alloys
Part of Physical Review B Condensed Matter, 2004
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Magnetic moments and exchange interactions in Fe0.82Ni0.18/V bcc(001) multilayers
Part of Physical Review B. Condensed Matter and Materials Physics, 2004
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Defect structure of Ga1−xMnxAs: A cross-sectional tunneling microscopy study
Part of Physical Review B, 2004
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Final state effects in the X-ray absorption spectra of La0.7Sr0.3MnO3
Part of Journal of Magnetism and Magnetic Materials, 2004
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Transport through quasi-degenerate states in coupled quantum dots
Part of pjotonics and nanostructres, p. 11, 2004
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Part of phys rev b, p. 85301, 2004
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A perfect spin-filter quantum dot system
Part of J phys cond matt, 2004
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Asymetric negative differential conductance in double quantum-dots
Part of J phys cond matt, 2004
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Electronic structure and magnetism of diluted magnetic semi conductors
Part of J phys cond matt, 2004
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First principles electronic structure calcualtions for intermediate valence f systems'
Part of phys rev lett, p. 96403, 2004
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Calculated electronic and transport poperties of Fe/GaAs/Fe (001) tunnel junctions
Part of surface science, p. 303, 2004
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GaMnAs studied by cross-sectional Scanning Tunneling Microscopy
Part of phys rev b, p. 85411, 2004
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Origin of the negative GMR effects in Cr_xCo_1-x/cu/Co (111) trilayers
Part of Physical Review B, 2004
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On the Magnetic and Crystalline Structure of Mn3IrSi
Part of phys rev b, p. 54422, 2004
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Pressure effect on the fermi surface and electronic structure of LuGa3 and TmGa3
Part of Check J of Phys, 2004
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Exchange interaction and magnetic percolation in diluted magnetic semiconductors
Part of J phys cond matt, 2004
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On the conditions for non-colinear magnetism
Part of phys rev lett., p. 107205-1, 2004
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Part of J.Electr. Spectr. and Rel. Phenom., p. 163, 2004
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A possible new MAX phase: Nb3SiC2
Part of j appl phys, p. 3071, 2004
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Intrinsic defects and transition metal impurities in GaAs
Part of J magn magn matt, 2004
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Part of phys rev b, p. 35302, 2004
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Part of j phys cond matt, p. 5241, 2004
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Tailor-made electronic and magnetic properties in one-dimensional perovskite-like oxides
Part of Physical Review Letters, p. 186404, 2003
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Doping-induced band gap narrowing in Si rich n- and p-type Si$_{1-x}$Ge$_x$
Part of Journal of Physics: Condensed Matter, p. 489, 2003
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On the magnetic anisotropy of Gd metal
Part of Physical Review Letters, p. 157201, 2003
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Electronic structure and magnetic properties of GdM$_2$ compounds
Part of Journal of Magnetism and Magnetic Materials, p. 520, 2003
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Initial and final state effects in the x-ray absorption process of La1-xSrxMnO3
Part of Physical Review B. Condensed Matter and Materials Physics, 2003
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Electronic structure and magnetic properties of Lithium manganese spinels
Part of Journal of Magnetism and Magnetic Materials, p. 287-289, 2003
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Photoemission and the electronic structure of PuGaCo$_5$
Part of Physical Review Letters, p. 176401, 2003
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Magnetic susceptibility of hcp iron and the seismic anisotropy of Earth's inner core
Part of PHYSICAL REVIEW B, 2003
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Part of International Journal of Quantum Chemistry, p. 113, 2003
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Fe/V and Fe/Co(001) superlattices: growth, anisotropy, magnetisation and magnetoresistance
Part of PHYSICA B-CONDENSED MATTER, p. 344-348, 2003
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Ab-initio calculation of depth resolved optical anisotropy of the Cu (110) surface
Part of Physical Review B, p. 35426, 2003
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Ferromagnetic materials in the zinc-blende structure
Part of Physical Review B. Condensed Matter and Materials Physics, 2003
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Magnetic and electronic structure of (Ga1-xMnx)As
Part of Physical Review B. Condensed Matter and Materials Physics, p. 205201, 2003
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Magnetism of Fe/V and Fe/Co multilayers
Part of Journal of Physics, 2003
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Origin of Magnetic Anisotropy of Gd Metal
Part of Physical Review Letters, p. 157201-157204, 2003
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Balanced crystal orbital overlap population: a tool for analysing chemical bonds in solids
Part of Journal of Physics, p. 7751-7761, 2003
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Evidence for initial and final state effects in the x-ray absorption spectrum of La(1-x)Sr(x)MnO3
Part of Physical Review B: Condensed Matter and Materials Physics, p. 235109, 2003
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Modeling the actinides with disordered local moments
Part of Physical Review B, p. 235105, 2003
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In-plane magnetic anisotropy of Fe/V (0 0 1) superlattices
Part of J. Magn. Magn. Mater., p. 260-270, 2002
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First-principles calculations of the magnetic anisotropy energy of Fe-V multilayers
Part of Phys. Rev. B, 2002
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Geometry of the Valence Transition Induced Surface Reconstruction of Sm(0001)
Part of Physical Review Letters, p. 136102, 2002
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Ground state and excited state properties of LaMnO$_3$ from full potential calculations
Part of Phys. Rev. B, p. 64445, 2002
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Many-body approach to spin-dependent transport in quantum dot systems
Part of Physical Review Letters, p. 226601, 2002
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Uniaxial magnetocrystalline anisotropy of metal/semiconductor interfaces: Fe/ZnSe(001)
Part of Physical Review Letters, p. 267203, 2002
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Non-collinear magnetization density in VAu4
Part of International Journal of Quantum Chemistry, p. 1610-1613, 2002
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H-H interaction and structural phase transition in Ti3SnHx
Part of Physical Review B. Condensed Matter and Materials Physics, p. 235104, 2002
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H-point vibration: precise solution of Mo, Fe and Na
Part of J.Phys. Cond. Matt., 2002
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Crystal Field Levels and Magnetic Susceptibility in PuO2
Part of Physical Review B, p. 195102-195108, 2002
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Crystal field levels and magnetic susceptibility of PuO$_2$: theory
Part of Phys. Rev. B, p. 195102, 2002
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Noncollinear magnetization density on VAu4
Part of Inter J Quant Chem, 2002
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Part of Phys. Rev. B, p. 195319, 2002
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Probing surface states of Cu/Ni thin films using x-ray absorption spectroscopy
Part of Physical Review B Condensed Matter, 2001
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Part of Physical Review B Condensed Matter, 2001
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Effects of nonorthogonality in the time-dependent current through tunnel junctions
Part of Physical Review B Condensed Matter, p. 153403, 2001
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Crystal field levels in lanthanide systems
Part of Journal of Magnetism and Magnetic Materials, p. 1027-1028, 2001
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The effect of hydrogenation on the crystal structure and magnetic state in Pd3Mn
Part of Journal of Magnetism and Magnetic Materials, p. 1040-1041, 2001
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Sign reversal of the orbital moment via ligand states - art. no. 172405
Part of PHYSICAL REVIEW B, p. 2405-+, 2001
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Electronic structure of the strongly hybridized ferromagnet CeFe2
Part of PHYSICAL REVIEW B, p. 14304-14312, 2000
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Non-collinear states in magnetic sensors
Part of NATURE, p. 280-282 Language: English, 2000
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Chemical vapour deposition of molybdenum carbides: aspects of phase stability
Part of THIN SOLID FILMS, p. 203-212, 2000
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Calculated trends of the magnetostriction coefficient of 3d alloys from first principles
Part of APPLIED PHYSICS LETTERS, p. 915-917, 2000
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Observation of short- and long-range hybridization of a buried Cu monolayer in Ni
Part of PHYSICAL REVIEW B, 2000
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Effect of hydrogenation on the magnetic state in cubic Pd3Mn
Part of Physical Review B Condensed Matter, p. 6765-6769, 1999
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On the non-orthogonality problem in the description of quantum devices
Part of Physica. B, Condensed matter, p. 28-30, 1999
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Theoretical studies of substitutional impurities in molybdenum carbide
Part of Physical Review B Condensed Matter, p. 15123-15130, 1999
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Crystal Field Excitations as Quasi-Particles
Part of Psi-k Scientific Highlights, 1999
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Probing the local electronic structure in the H induced metal-insulator transition of Y
Part of JOURNAL OF PHYSICS-CONDENSED MATTER, 1999
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Theoretical study of structural and electronic properties of VHx
Part of Physical Review B Condensed Matter, p. 5230-5235, 1998
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Experimental and theoretical identification of a new high-pressure phase of silica
Part of NATURE, p. 362-365, 1997
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Cluster approach to transport through complex nanostructures
Part of (Manuscript)
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A new alloy for information storage
Part of Nature Materials
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Ab-initio calculations of the phonon spectrum and the thermal expansion for the 4d metals
Part of Phys. Rev. B, p. 1-7
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Theory of the Temperature Dependence of the Easy Axis of Magnetization in Gd Metal
Part of Physical Review B
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Charge transfer effets in x-ray absorption spectroscopy of transition metal oxides
Part of Phys. Rev. Lett.
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On the unaixial magnetocrystalline anisotropy of metal/semiconductor interfaces; Fe/ZnSe(001)
Part of Phys. Rev. Lett.
Articles, review/survey
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Charge-state dependent spin-orbit coupling and quantum phase transitions in Ir-Ru oxides
Part of Physical Review B, 2025
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Quantitative theory of magnetic interactions in solids
Part of Reviews of Modern Physics, 2023
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Atomistic spin dynamics and surface magnons
Part of Journal of Physics, 2015
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Part of Journal of Electron Spectroscopy and Related Phenomena, p. 92-97, 2015
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Part of Journal of Physics, p. 445201, 2008
Chapters in book
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Theory of diluted magnetic semiconductors
Part of Advanced Functional Materials, p. 1-19, Elsevier, 2012
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Magnetic anisotropy from first principles
Part of Physics of Spin in Solids, p. 263-287, Kluwer Academic Publishers, the Netherlands, 2004
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Electronic structure calculations of phase stability: cohesive and elastic properties
Part of Encyclopedia of materials, Elsevier, Oxford, 2004
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Lågdimensionell magnetism; en samlingsplats för experiment, teori och industri
Part of Kosmos 2001, p. 77, 2001
Conference papers
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Part of Frontiers in Optics + Laser Science 2024 (FiO, LS), 2024
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Different fingerprints for the OISTR mechanism in the magnetic alloys experiments
Part of ADVANCES IN ULTRAFAST CONDENSED PHASE PHYSICS III, 2022
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Coarse-Graining Approach to Atomistic SpinDynamics
Part of ULTRAFAST MAGNETISM I, p. 162-165, 2015
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Laser heated ferromagnetic simulations
Part of Ultrafast Magnetism I, p. 76-78, 2015
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Evanescent exchange magnons in a 1D magnonic crystal
Part of Ultrafast Magnetism I, p. 94-97, 2015
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Nanoscale structural and electronic modifications of graphene
2015
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Dynamic stabilization of cubic AuZn
Part of Materials today: Proceedings, 2015
- DOI for Dynamic stabilization of cubic AuZn
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Tribochemically active Ti-C-S nanocomposites – a new concept for self-lubricating coatings
2013
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Part of Proceedings of the 15th European Microscopy Congress: Volume 2: Physical Sciences: Tools and Techniques, p. 727-728, 2012
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Conduction properties of graphene as a function of ion irradiation and acid treatment
Part of Graphene 2011 - 11th to 14th April 2011. Bilbao, Spain., 2011
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Influence of plural scattering on quantitative magnetic information measured by EMCD
Part of 10th Multinational Congress on Microscopy, Urbino, Italy; 4-9 Sep. 2011, p. 43-44, 2011
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Calculations of orientation-sensitive ELNES on crystalline materials
2010
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Part of IMC 17, Rio de Janeiro,19-24 September 2010; Proceedings, 2010
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Mapping of the EMCD signal in real and reciprocal space forquantitative analysis of magnetic samples
Part of Scandem 2010 Proceedings; Stockholm, Sweden, 8-11 June 2010, 2010
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Electron Microscopy studies on stainless steel transfer onto a TiN coated cutting tool
2010
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Electron Microscopy studies on stainless steel transfer onto a TiN coated cutting tool
Part of 17th International Microscopy Congress - Rio de Janeiro19-24 September 2010, 2010
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The effect of induced vacancy defects on resistivity of graphene
Part of Scandem conference, Reykjavik 2009, 2009
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In-situ contacting of nanosheets and remote EMCD
Part of 2nd International Workshop on Remote Electron Microscopy and In Situ Studies, Gothenburg, Sweden 16-18 November 2009, 2009
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Electrical characterization of defect induced graphene nanosheets
Part of Nanotech Europe 2009 - 28-30 september Berlin, 2009
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Quantitative EMCD yields nano-information on magnetic moments
Part of EDGE 2009: International EELS-Workshop, May 17 – May 22, 2009, Banff, Alberta, Canada, 2009
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On precision of ELNES calculations for EMCD applications
Part of MC 2009 - Microscopy Conference 2009 in Graz, Austria 30/8-4/9 2009, 2009
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Conductivity engineering of graphene and carbon nanosheets by defect formation
Part of Conference of the American Vacuum Society, Boston, 2008, 2008
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Control of Conductivity in Graphene by Formation of Defects
Part of AVS 55th International Symposium & Exhibition 2008, October 19-24, Boston, USA, 2008
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EMCD in the TEM - Optimization of signal acquisition and data evaluation
2008
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Electron magnetic circular dichroism -Optimization of signal acquisition and data evaluation
Part of European Microscopy Conference, Aachen, 2008, 2008
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Conductivity engineering of graphene and carbon nanosheets by defect formation
Part of Conference of the American Vacuum Society, Boston, 2008, 2008
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Intercalation and Ultrasonic Treatment of Graphite: a New Synthetic Route to Graphene
2008
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Experimental conditions and data evaluation forquantitative EMCD measurements in the TEM
Part of European Microscopy Conference, 2008
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Control of Conductivity in Graphene by Formation of Defects
p. 59-59, 2008
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Electronic and geometric structure of (Zn,Co)O room temperature Ferromagnets
Part of 50th MMM Meeting Program, 2005
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Theoretical studies of substoichiometric MoC_(1-x)
Part of Proceedings of the International Conference on Solid-SolidPhase Transformations '99, 1999
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The effect of induced vacancy defects on resistivity of graphene
Part of Scandem conference
Manuscripts (preprints)
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The role of pressure-induced stacking faults on the magnetic properties of gadolinium
2023
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Giant magnetocaloric effect in the (Mn,Fe)NiSi-system
2023
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Multilayers of rare-earth and transition metals—a high moment magnetic material
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Magnetic structure of Fe, Cr, and Mn clusters supported on Cu(111).
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Elasticity model for the calculation of lattice parameters in multilayer structures
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Spin dynamics of a Heisenberg model in an external and uniaxial anisotropy field
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Spin dynamics simulations on an electron beam switching experiment
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Ultrafast switching in AFM bilayers; a first principles spin dynamics simulation
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Theoretical investigation of the volume collapse of CeOFeAs under pressure
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Self-interaction correction scheme for a full-potential linear muffin-tin orbital method
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A first principles study of the stability and mobility of defects in titanium carbide
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Excitation spectra of the frustrated ZnMnSe and CdMnTe spin glass alloys
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Atomistic spin dynamics simulations of ferrimagnetic relaxation
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Magnetic asymmetry around the 3p absorption edge in Fe and Ni
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Approximate Molecular and Crystal Field Excitation Energies Derived from Density Functional Theory
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Theoretical investigation of a pressure induced phase transition in EuCo2P2
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Electronic structure and x-ray absorption spectroscopy of TiO2 and LiTi2O4
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First-principles Dzyaloshinskii-Moryia interaction in a non-collinear framework
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Doping induced site-selective Mott insulating phase in LaFeO3
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The standard model of the rare-earths, analyzed from the Hubbard-Iapproximation
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Ultrafast switching in a synthetic antiferromagnetic random-access memory device.
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Surface and interface properties of graphene on titanium carbide: A first principles study
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Ultrafast magnetization dynamics in magnetically frustrated NiFe2O4 ferrimagnet
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Ultrafast dynamics in Fe65Co35 alloys: Effect of Re doping
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Ultrafast magnetization dynamics in half-metallic Co2FeAl Heusler alloy
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Magnetocaloric properties of nonstoichiometric Fe2P-type intermetallics near room temperature
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Magneto-structural coupling strength dependent giant magnetocaloric effect in (Mn,Fe)NiSi-system
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Superconductivity in amorphous MoxGe100-x: insights from first principles
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Other
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Part of PHYSICAL REVIEW B, p. 4409-+ Language: English, 2001