Publications

Fundamentals of Time-Dependent Density Functional Theorypp 265-276 (Eds.) Marques, M A. L., Maitra, N. T., Nogueira, F. M. S., Gross, E. K. U. and Rubio, A.,Springer, Heidelberg, Germany 2012

TH-2012-08

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Chiang, C.-T., Winkelmann, A., Henk, J., Bisio, F., Kirschner, J.

Spin-selective pathways in linear and nonlinear photoemission from ferromagnets

Physical Review B 85, (16),pp 165137/1-4 (2012)

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Chulkov, E. V., Sklyadneva, I. and Kira, M., Koch, St. W., Pitarke, J. M., Sandratskii, L. M., Buczek, P., Ishioka, K., Schäfer, J., Weinelt, M.

Quasi-particles and collective excitations

Dynamics at Solid State Surfaces and Interfaces. Volume 2: Fundamentalspp 27-113 (Eds.) Bovensiepen, U., Petek, H. and Wolf, M.,WILEY-VCH, Weinheim, Germany 2012

TH-2012-20

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Dasa, T. R., Ignatiev, P. A., Stepanyuk, V. S.

Effect of the electric field on magnetic properties of linear chains on a Pt(111) surface

Physical Review B 85, (20),pp 205447/1-7 (2012)

TH-2012-24

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Eremeev, S. V., Landolt, G., Menshchikova, T. V., Slomski, B., Koroteev, Y. M., Aliev, Z. S., Babanly, M. B., Henk, J., Ernst, A., Patthey, L., Eich, A., Khajetoorians, A. A., Hagemeister, J., Pietzsch, O., Wiebe, J., Wiesendanger, R., Echenique, P. M., Tsirkin, S. S., Amiraslanov, I. R., Dil, J. H., Chulkov, E. V.

Atom-specific spin mapping and buried topological states in a homologous series of topological insulators

Nature Communications 3, (6),pp 635/1-7 (2012)

TH-2012-09

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Gross, E. K. U., Maitra, N. T.

Introduction to TDDFT

Fundamentals of Time-Dependent Density Functional Theorypp 53-99 (Eds.) Marques, M A. L., Maitra, N. T., Nogueira, F. M. S., Gross, E. K. U. and Rubio, A.,Springer, Heidelberg, Germany 2012

TH-2012-06

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Haunschild, R., Odashima, M. M., Scuseria, G. E., Perdew, J. P., Capelle, K.

Hyper-generalized-gradient functionals constructed from the Lieb-Oxford bound: Implementation via local hybrdis and thermochemical assessment

Journal of Chemical Physics 136, (18),pp 184102/1-7 (2012)

Th-2012-17

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Hellgren, M., Gross, E. K. U.

Effect of discontinuities in Kohn-Sham-based chemical reactivity theory

Journal of Chemical Physics 136, (11),pp 114102/1-6 (2012)

TH-2012-14

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Hellgren, M., Gross, E. K. U.

Discontinuities of the exchange-correlation kernel and charge transfer excitations in time-dependent density-functional theory

Physical Review A 85, (2),pp 022514/1-6 (2012)

Th-2012-12

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Hellgren, M., Rohr, D. R., Gross, E. K. U.

Correlation potentials for molecular bond dissociation within the self-consistent random phase approximation

The Journal of Chemical Physics 136, (3),pp 034106/1-9 (2012)

TH-2012-05

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Henk, J., Ernst, A., Eremeev, S. V., Chulkov, E. V., Maznichenko, I. V., Mertig, I.

Complex spin texture in the pure and Mn-doped topological insulator Bi₂Te₃

Physical Review Letters 108, (20),pp 20681/1-5 (2012)

TH-2012-19

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Khosravi, E., Uimonen, A.-M., Stan, A., Stefanucci, G., Kurth, S., van Leeuwen, R., Gross, E. K. U.

Correlation effects in bistability at the nanoscale: Steady state and beyond

Physical Review B 85, (7),pp 071503/1-12 (2012)

TH-2012-10

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van Leeuwen, R., Gross, E. K. U.

Multicomponent density-functional theory

Fundamentals of Time-Dependent Density Functional Theorypp 249-263 (Eds.) Marques, M A. L., Maitra, N. T., Nogueira, F. M. S., Gross, E. K. U. and Rubio, A.,Springer, Heidelberg, Germany 2012

TH-2012-07

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Meyerheim, H. L., Crozier, E. D., Gordon, R. A., Xiao, Q. F., Mohseni, K., Negulyaev, N. N., Stepanyuk, V. S., Kirschner, J.

Direct proof of mesoscopic misfit in nanoscale islands by X-ray absorption spectroscopy

Physical Review B 85, (12),pp 12405/1-9 (2012)

TH-2012-11

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Meyerheim, H. L., Ernst, A., Mohseni, K., Maznichenko, I. V., Ostanin, S., Klimenta, F., Jedrecy, N., Feng, W., Mertig, I., Felici, R., Kirschner, J.

BaTiO₃(001)-(2x1): Surface structure and spin density

Physical Review Letters 108, (21),pp 215502/1-5 (2012)

TH-2012-25

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