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Journal Article (126)

  1. 2016
    MPG.PuRe
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    Journal Article
    E. Torun, H. Sahin, S. Cahangirov, Angel Rubio, and F. M. Peeters, "Anisotropic electronic, mechanical, and optical properties of monolayer WTe2," Journal of Applied Physics 119 (7), 074307 (2016).
  2. MPG.PuRe
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    Marco Casadei, Xinguo Ren, Patrick Rinke, Angel Rubio, and Matthias Scheffler, "Density functional theory study of the α−γ phase transition in cerium: Role of electron correlation and f-orbital localization," Physical Review B 93 (7), 075153 (2016).
  3. MPG.PuRe
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    Livia Noëmi Glanzmann, Duncan John Mowbray, Diana Gisell Figueroa del Valle, Francesco Scotognella, Guglielmo Lanzani, and Angel Rubio, "Photoinduced Absorption within Single-Walled Carbon Nanotube Systems," The Journal of Physical Chemistry C 120 (3), 1926-1935 (2016).
  4. 2015
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    Xavier Andrade, David A. Strubbe, Umberto De Giovannini, Ask Hjorth Larsen, Micael J. T. Oliveira, Joseba Alberdi-Rodriguez, Alejandro Varas, Iris Theophilou, Nicole Helbig, Matthieu Verstraete, Lorenzo Stella, Fernando Nogueira, Alán Aspuru-Guzik, Alberto Castro, Miguel A. L. Marques, and Angel Rubio, "Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems," Physical Chemistry Chemical Physics 17 (47), 31371-31396 (2015).
  5. MPG.PuRe
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    pre-print
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    Johannes Flick, Michael Ruggenthaler, Heiko Appel, and Angel Rubio, "Kohn–Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space," Proceedings of the National Academy of Sciences of the United States of America 112 (50), 15285-15290 (2015).
  6. MPG.PuRe
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    Hong Zhang, Yoshiyuki Miyamoto, Xinlu Chengc, and Angel Rubio, "Optical field terahertz amplitude modulation by graphene nanoribbons," Nanoscale 7 (45), 19012-19017 (2015).
  7. MPG.PuRe
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    Jørgen Houmøller, Marius Wanko, Angel Rubio, and Steen Brøndsted Nielsen, "Effect of a Single Water Molecule on the Electronic Absorption by o- and p-Nitrophenolate: A Shift to the Red or to the Blue?," The Journal of Physical Chemistry A 119 (47), 11498-11503 (2015).
  8. MPG.PuRe
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    Journal Article
    M. Bala Murali Krishna, Michael K. L. Man, Soumya Vinod, Catherine Chin, Takaaki Harada, Jaime Taha-Tijerina, Chandra Sekhar Tiwary, Patrick Nguyen, Patricia Chang, Tharangattu N. Narayanan, Angel Rubio, Pulickel M. Ajayan, Saikat Talapatra, and Keshav M. Dani, "Engineering Photophenomena in Large, 3D Structures Composed of Self-Assembled van der Waals Heterostructure Flakes," Advanced Optical Materials 3 (11), 1551-1556 (2015).
  9. MPG.PuRe
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    Journal Article
    Joaquim Jornet-Somoza, Joseba Alberdi-Rodriguez, Bruce F. Milne, Xavier Andrade, Miguel A. L. Marques, Fernando Nogueira, Micael J. T. Oliveira, James J. P. Stewart, and Angel Rubio, "Insights into colour-tuning of chlorophyll optical response in green plants," Physical Chemistry Chemical Physics 17 (40), 26599-26606 (2015).
  10. MPG.PuRe
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    Journal Article
    Mark H. Stockett, Lihi Musbat, Christina Kjær, Jørgen Houmøller, Yoni Toker, Angel Rubio, Bruce F. Milne, and Steen Brøndsted Nielsen, "The Soret absorption band of isolated chlorophyll a and b tagged with quaternary ammonium ions," Physical Chemistry Chemical Physics 17 (39), 25793-25798 (2015).
  11. MPG.PuRe
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    pre-print
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    Camilla Pellegrini, Johannes Flick, Ilya V. Tokatly, Heiko Appel, and Angel Rubio, "Optimized Effective Potential for Quantum Electrodynamical Time-Dependent Density Functional Theory," Physical Review Letters 115 (9), 093001 (2015).
  12. MPG.PuRe
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    Iris Theophilou, Nektarios N. Lathiotakis, Nikitas I. Gidopoulos, Angel Rubio, and Nicole Helbig, "Orbitals from local RDMFT: Are they Kohn-Sham or natural orbitals?," The Journal of Chemical Physics 143 (5), 054106 (2015).
  13. MPG.PuRe
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    Alberto Castro, Angel Rubio, and Eberhard K. U. Gross, "Enhancing and controlling single-atom high-harmonic generation spectra: a time-dependent density-functional scheme," European Physical Journal B 88 (8), 191 (2015).
  14. MPG.PuRe
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    Journal Article
    Robert Biele, Roberto D'Agosta, and Angel Rubio, "Time-Dependent Thermal Transport Theory," Physical Review Letters 115 (5), 056801 (2015).
  15. MPG.PuRe
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    Journal Article
    Huijuan Sun, Duncan J. Mowbray, Annapaola Migani, Jin Zhao, Hrvoje Petek, and Angel Rubio, "Comparing quasiparticle H2O level alignment on anatase and rutile TiO2," ACS Catalysis 5 (7), 4242-4254 (2015).
  16. MPG.PuRe
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    Journal Article
    Alejandro Varas, Pablo García-González, F. J. García-Vidal, and Angel Rubio, "Anisotropy Effects on the Plasmonic Response of Nanoparticle Dimers," The Journal of Physical Chemistry Letters 6 (10), 1891-1898 (2015).
  17. MPG.PuRe
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    Journal Article
    Guillermo Albareda, Josep Maria Bofill, Ivano Tavernelli, Fermin Huarte-Larrañaga, Francesc Illas, and Angel Rubio, "Conditional Born−Oppenheimer Dynamics: Quantum Dynamics Simulations for the Model Porphine," The Journal of Physical Chemistry Letters 6 (9), 1529-1535 (2015).
  18. MPG.PuRe
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    Journal Article
    Kristian B. Ørnsø, Juan M. Garcia-Lastra, Gema De La Torre, F. J. Himpsel, Angel Rubio, and Kristian S. Thygesen, "Design of two-photon molecular tandem architectures for solar cells by ab initio theory," Chemical Science 6 (5), 3018-3025 (2015).
  19. MPG.PuRe
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    Journal Article
    Maria Hellgren, Fabio Caruso, Daniel R. Rohr, Xinguo Ren, Angel Rubio, Matthias Scheffler, and Patrick Rinke, "Static correlation and electron localization in molecular dimers from the self-consistent RPA and GW approximation," Physical Review B 91 (16), 165110 (2015).
  20. MPG.PuRe
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    Journal Article
    Pierluigi Cudazzo, Francesco Sottile, Angel Rubio, and Matteo Gatti, "Exciton dispersion in molecular solids," Journal of Physics: Condensed Matter 27 (11), 113204 (2015).
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