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Theory Department
Max Planck Institute of Microstructure Physics

Theory Department >> Publications

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2008

Antonov, V. N., Ernst, A., Maznichenko, I. V., Yaresko, A. N., Shpak, A. P.

Electronic structure and x-ray magnetic circular dichroism in Heusler-type Fe_2−xV_1+xAl: First-principles calculations

Physical Review B 77, (13),pp 134444/1-8 (2008)

TH-2008-09

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Ast, C. R., Pacilé, D., Moreschini, L., Falub, M. C., Papagno, M., Kern, K., Grioni, M., Henk, J., Ernst, A., Ostanin, S. A., Bruno, P.

Spin-orbit split two-dimensional electron gas with tunable Rashba and Fermi energy

Physical Review B 77, (8),pp 081407(R)/1-4 (2008)

TH-2008-03

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Balashov, T., Takács, A. F., Däne, M., Ernst, A., Bruno, P., Wulfhekel, W.

Inelastic electron-magnon interaction and spin transfer torque

Physical Review B 78, (17),pp 174404/1-5 (2008)

TH-2008-23

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Borisova, S. D., Eremeev, S. V., Rusina, G. G., Stepanyuk, V. S., Bruno, P., Chulkov, E. V.

Vibrations of small cobalt clusters on low-index surfaces of copper: Tight-binding simulations

Physical Review B 78, (7),pp 075428/1-17 (2008)

TH-2008-18

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Bose, P., Ernst, A., Mertig, I., Henk, J.

Large reduction of the magnetoresistance in Fe/MgO/Fe tunnel junctions due to small oxygen concentrations at a single FeO interface layer: A first-principles study

Physical Review B 78, (9),pp 092403/1-4 (2008)

TH-2008-19

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Brovko, O. O., Ignatiev, P. A., Stepanyuk, V. S., Bruno, P.

Tailoring exchange interactions in engineered nanostructures: An ab initio study

Physical Review Letters 101, (3),pp 036809/1-4 (2008)

TH-2008-15

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Brovko, O. O., Stepanyuk, V. S., Bruno, P.

Effect of exchange interaction on the spin-polarized bound states on metal surfaces: Ab initio study

Physical Review B 78, (16),pp 165413/1-5 (2008)

TH-2008-21

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Fechner, M., Maznichenko, I. V., Ostanin, S. A., Ernst, A., Henk, J., Bruno, P., Mertig, I.

Magnetic phase transition in two-phase multiferroics predicted from first principles

Physical Review B 78, (21),pp 212406/1-4 (2008)

TH-2008-27

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Frantzeskakis, E., Pons, S., Mirhosseini, H., Henk, J., Ast, C. R., Grioni, M.

Tunable spin gaps in a quantum-confined geometry

Physical Review Letters 101, (19),pp 196805/1-4 (2008)

TH-2008-24

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Gao, C. L., Ernst, A., Fischer, G., Hergert, W., Bruno, P., Wulfhekel, W., Kirschner, J.

Spin wave dispersion on the nanometer scale

Physical Review Letters 101, (16),pp 167201/1-4 (2008)

TH-2008-22

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Gao, C. L., Ernst, A., Winkelmann, A., Henk, J., Wulfhekel, W., Bruno, P., Kirschner, J.

Noncollinear surface spin density by surface reconstruction in the alloy NiMn

Physical Review Letters 100, (23),pp 237203/1-4 (2008)

TH-2008-12

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Hortamani, M., Sandratskii, L. M., Kratzer, P., Mertig, I., Scheffler, M.

Exchange interactions and critical temperature of bulk and thin films of MnSi: A density functional theory study

Physical Review B 78, (10),pp 104402/1-9 (2008)

TH-2008-28

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Hughes, I. D., Däne, M., Ernst, A., Hergert, W., Lüders, M., Staunton, J. B., Szotek, Z., Temmerman, W. M.

Onset of magnetic order in strongly-correlated systems from ab initio electronic structure calculations: Application to transition metal oxides

New Journal of Physics 10, (6),pp 063010/1-13 (2008)

TH-2008-11

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Khan, M. N., Henk, J., Bruno, P.

Anisotropic magnetoresistance in Fe/MgO/Fe tunnel junctions

Journal of Physics: Condensed Matter 20, (15),pp 155208/1-8 (2008)

TH-2008-05

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Meyerheim, H. L., Sander, D., Negulyaev, N. N., Stepanyuk, V. S., Popescu, R., Popa, I., Kirschner, J.

Buried Ni/Cu(001) interface at the atomic scale

Physical Review Letters 100, (14),pp 146101/1-4 (2008)

TH-2008-08

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Mirhosseini, H., Saha, K. K., Ernst, A., Henk, J.

Electron correlation effects in the magnetoresistance of Fe/MgO/Fe tunnel junctions: First-principles calculations

Physical Review B 78, (1),pp 012404/1-4 (2008)

Th-2008-13

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Mironets, O., Meyerheim, H. L., Tusche, C., Stepanyuk, V. S., Soyka, E., Zschack, P., Hong, H., Jeutter, N., Felici, R., Kirschner, J.

Direct evidence for mesoscopic relaxations in cobalt nanoislands on Cu(001)

Physical Review Letters 100, (9),pp 096103/1-4 (2008)

TH-2008-06

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Mulazzi, M., Hochstasser, M., Fujii, J., Vobornik, I., Rossi, G., Henk, J.

Magnetization-induced symmetry breaking at the surface of ferromagnetic Ni(111)

Europhysics Letters 82, (5),pp 57001/1-5 (2008)

TH-2008-10

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Negulyaev, N. N., Stepanyuk, V. S., Bruno, P., Diekhöner, L., Wahl, P., Kern, K.

Bilayer growth of nanoscale Co islands on Cu(111)

Physical Review B 77, (12),pp 125437/1-7 (2008)

TH-2008-07

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Negulyaev, N. N., Stepanyuk, V. S., Hergert, W., Bruno, P., Kirschner, J.

Atomic-scale self-organization of Fe nanostripes on stepped Cu(111) surfaces: Molecular dynamics and kinetic Monte Carlo simulations

Physical Review B 77, (8),pp 085430/1-9 (2008)

TH-2008-04

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Negulyaev, N. N., Stepanyuk, V. S., Niebergall, L., Bruno, P., Hergert, W., Repp, J., Rieder, K.-H., Meyer, G.

Direct evidence for the effect of quantum confinement of surface-state electrons on atomic diffusion

Physical Review Letters 101, (22),pp 226601/1-4 (2008)

TH-2008-26

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Saha, K. K., Henk, J., Ernst, A., Bruno, P.

Multiple-scattering theoretical approach to scanning tunneling microscopy

Physical Review B 77, (8),pp 085427/1-12 (2008)

TH-2008-02

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Sandratskii, L. M.

Thermal magnetic properties of the Ni sublattice in half-metallic NiMnSb: A theoretical study based on first-principles calculations

Physical Review B 78, (9),pp 094425/1-12 (2008)

TH-2008-20

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Schiffrin, A., Reichert, J., Auwärter, W., Jahnz, G., Pennec, Y., Weber-Bargioni, A., Stepanyuk, V. S., Niebergall, L., Bruno, P., Barth, J. V.

Self-aligning atomic strings in surface-supported biomolecular gratings

Physical Review B 78, (3),pp 035424/1-7 (2008)

TH-2008-14

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Smelova, K. M., Bazhanov, D. I., Stepanyuk, V. S., Hergert, W., Saletsky, A. M., Bruno, P.

Interplay between magnetism and structure in atomic-size Pd contacts: Ab initio studies

Physical Review B 77, (3),pp 033408/1-4 (2008)

TH-2008-01

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Smirnov, A. S., Negulyaev, N. N., Niebergall, L., Hergert, W., Saletsky, A. M., Stepanyuk, V. S.

Effect of quantum confinement of surface electrons on an atomic motion on nanoislands: Ab initio calculations and kinetic Monte Carlo simulations

Physical Review B 78, (4),pp 041405(R)/1-4 (2008)

TH-2008-16

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Tao, K., Stepanyuk, V. S., Bruno, P., Bazhanov, D. I., Maslyuk, V. V., Brandbyge, M., Mertig, I.

Manipulating magnetism and conductance of an adatom-molecule junction on a metal surface: An ab initio study

Physical Review B 78, (1),pp 014426/1-4 (2008)

TH-2008-17

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Vitali, L., Ohmann, R., Stepanow, S., Gambardella, P., Tao, K., Huang, R. Z., Stepanyuk, V. S., Bruno, P., Kern, K.

Kondo effect in single atom contacts: The importance of the atomic geometry

Physical Review Letters 101, (21),pp 216802/1-4 (2008)

TH-2008-25

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