Publications

L. Shi, P. Rohringer, K. Suenaga, Y. Niimi, J. Kotakoski, J. C. Meyer, H. Peterlik, M. Wanko, S. Cahangirov, A. Rubio, Z. J. Lapin, L. Novotny, P. Ayala, T. Pichler

Nature Materials 15 (6), 634–639 (2016)

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DOI

pre-print

Journal Article

On the Exciton Coupling between Two Chlorophyll Pigments in the Absence of a Protein Environment: Intrinsic Effects Revealed by Theory and Experiment

B. F. Milne, C. Kjær, J. Houmøller, M. H. Stockett, Y. Toker, A. Rubio, S. B. Nielsen

Angewandte Chemie International Edition 55 (21), 6248–6251 (2016)

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publisher-version

Journal Article

The mechanical bond on carbon nanotubes: diameter-selective functionalization and effects on physical properties

E. Martínez-Periñán, A. de Juan, Y. Pouillon, C. Schierl, V. Strauss, N. Martín, A. Rubio, D. M. Guldi, E. Lorenzo, E. Pérez

Nanoscale 8 (17), 9254–9264 (2016)

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Journal Article

Tailored pump-probe transient spectroscopy with time-dependent density-functional theory: controlling absorption spectra

J. Walkenhorst, U. De Giovannini, A. Castro, A. Rubio

European Physical Journal B 89 (5), 128 (2016)

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pre-print

Journal Article

Theory of light-enhanced phonon-mediated superconductivity

M. A. Sentef, A. F. Kemper, A. Georges, C. Kollath

Physical Review B 93 (14), 144506 (2016)

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publisher-version

Journal Article

Bilayer SnS₂: Tunable stacking sequence by charging and loading pressure

C. Bacaksiz, S. Cahangirov, A. Rubio, R. T. Senger, F. M. Peeters, H. Sahin

Physical Review B 93 (12), 125403 (2016)

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publisher-version

Journal Article

Validity of power functionals for a homogeneous electron gas in reduced-density-matrix-functional theory

A. Putaja, F. G. Eich, T. Baldsiefen, E. Räsänen

Physical Review A 93 (3), 032503 (2016)

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publisher-version

Journal Article

Anisotropic electronic, mechanical, and optical properties of monolayer WTe₂

E. Torun, H. Sahin, S. Cahangirov, A. Rubio, F. M. Peeters

Journal of Applied Physics 119 (7), 074307 (2016)

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publisher-version

Journal Article

Determination of scattering time and of valley occupation in transition-metal dichalcogenides doped by field effect

T. Brumme, M. Calandra, F. Mauri

Physical Review B 93 (8), 081407(R) (2016)

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publisher-version

supplementary-material

Journal Article

Density functional theory study of the α−γ phase transition in cerium: Role of electron correlation and f-orbital localization

M. Casadei, X. Ren, P. Rinke, A. Rubio, M. Scheffler

Physical Review B 93 (7), 075153 (2016)

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publisher-version

Journal Article

Photoinduced Absorption within Single-Walled Carbon Nanotube Systems

L. N. Glanzmann, D. J. Mowbray, D. G. F. del Valle, F. Scotognella, G. Lanzani, A. Rubio

The Journal of Physical Chemistry C 120 (3), 1926–1935 (2016)

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Book Chapter (1)

2016

Book Chapter

Dynamical Processes in Open Quantum Systems from a TDDFT Perspective: Resonances and Electron Photoemission

A. H. Larsen, U. De Giovannini, A. Rubio

In: N. Ferré, M. Filatov, M. Huix-Rotllant, editors. vol. 368, Cham, Switzerland: Springer International Publishing; 2016, p. 219–271

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Conference Paper (1)

2016

Conference Paper

First-principles calculations for initial electronic excitation in dielectrics induced by intense femtosecond laser pulses

S. Sato, K. Yabana

LASER-INDUCED DAMAGE IN OPTICAL MATERIALS 2016, Bellingham, Washington USA: SPIE; 2016

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Thesis - PhD (2)

2016

Thesis - PhD

Exact nonadiabatic many-body dynamics: electron-phonon coupling in photoelectron spectroscopy and light-matter interactions in quantum electrodynamical density-functional theory

J. Flick

Humboldt-Universität zu Berlin, 2016

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Abstr

Thesis - PhD

Analysis and Control of Transient Spectra Using Time-Dependent Density Functional Theory

J. Walkenhorst

University of the Basque Country UPV/EHU, 2016

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publisher-version

Abstr