Publications: FunTheMaS: Fundamental Theoretical Materials Science


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These papers are ordered by article influence.

Enhancement of Spin-charge Conversion in Dilute Magnetic Alloys by Strong Electronic Correlations
C. Huang, I. V. Tokatly, M. A. Cazalilla
Physical Review Letters (submitted), (2020)
Light-induced renormalization of the Dirac quasiparticles in the nodal-line semimetal ZrSiSe
G. Gatti, A. Crepaldi, M. Puppin, N. Tancogne-Dejean, L. Xian, S. Roth, S. Polishchuk, Ph. Bugnon, A. Magrez, H. Berger, F. Frassetto, L. Poletto, L. Moreschini, S. Moser, A. Bostwick, E. Rotenberg, A. Rubio, M. Chergui, M. Grioni
Physical Review Letters 125, 076401 (2020)
Mott metal-insulator transition from steady-state density functional theory
David Jacob, Gianluca Stefanucci, Stefan Kurth
Physical Review Letters 125, 216401 (2020)
Nature of Symmetry Breaking at the Excitonic Insulator Transition:Ta2 NiSe5
Giacomo Mazza, Malte Rösner, Lukas Windgätter, Simone Latini, Hannes Hübener, Andrew J. Millis, Angel Rubio, Antoine Geroges
Physical Review Letters 124, 19, 197601 (2020)
Polaritonic Chemistry: Collective Strong Coupling Implies Strong Local Modification of Chemical Properties
Dominik Sidler, Christian Schäfer, Michael Ruggenthaler, Angel Rubio
Journal Of Physical Chemistry Letters 12, 508 - 516 (2020)
Light-matter hybrid-orbital-based first-principles methods: the influence of the polariton statistics
Florian Buchholz, Iris Theophilou, Klaas J. H. Giesbertz, Michael Ruggenthaler, Angel Rubio
Journal Of Chemical Theory And Computation 16, 9, 5601 - 5620 (2020)
Gap inversion in one-dimensional Andreev crystals
M. Rouco, F. S. Bergeret, I. V. Tokatly
Physical Review B (submitted), (2020)
Topological Phase Transitions Induced by Disorder in Magnetically Doped (Bi, Sb)2Te3 Thin Films
Takuya Okugawa, Peizhe Tang, Angel Rubio, Dante M. Kennes
Physical Review B 102,20, 201405(R) (2020)
Exchange-correlation potentials for multi-orbital quantum dots subject to generic density-density interactions and Hund’s rule coupling
Nahual Sobrino, Stefan Kurth, David Jacob
Physical Review B 102, 035159 (2020)
Theory of the magnetic response in finite two-dimensional superconductors
F. S. Bergeret, I. V. Tokatly
Physical Review B 102, 060506 (2020)
Parameter-free hybrid functional based on an extended Hubbard model: DFT+U+V
Nicolas Tancogne-Dejean, Angel Rubio
Physical Review B 102, 155117 (2020)
Unified description of spin transport, weak antilocalization, and triplet superconductivity in systems with spin-orbit coupling
S. Ilić, I. V. Tokatly, F. S. Bergeret
Physical Review B 102, 235430 (2020)
Quantification of interfacial spin-charge conversion in metal/insulator hybrid structures by generalized boundary conditions
C. Sanz-Fernández, V. T. Pham, E. Sagasta, L. E. Hueso, I. V. Tokatly, F. Casanova, F. S. Bergeret
Applied Physics Letters 117, 142405 (2020)
Single- and double-charge transfer in the Ne2+ + He collision within time-dependent density-functional theory
Wandong Yu,Cong-Zhang Gao,Shunsuke A. Sato,Alberto Castro,Angel Rubio, Baoren Wei1
Physical Review A (submitted), (2020)
Effect of Many Modes on Self-Polarization and Photochemical Suppression in Cavities
Norah M. Hoffmann, Lionel Lacombe, Angel Rubio, Neepa T. Maitra
Journal of Chemical Physics 153, 10, 104103 (2020)