A
Angel Rubio
Researcher at Max Planck Society
Publications - 1033
Citations - 61779
Angel Rubio is an academic researcher from Max Planck Society. The author has contributed to research in topics: Density functional theory & Carbon nanotube. The author has an hindex of 110, co-authored 930 publications receiving 52731 citations. Previous affiliations of Angel Rubio include University of California, Berkeley & Universidad Autónoma Metropolitana.
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Persistent currents in carbon nanotube based rings
TL;DR: The case of interacting nanotori and self-interacting coiled nanotubes is analyzed in detail in relation to experiments in this paper, where the contribution of finite temperature or quenched disorder on covalent rings is addressed.
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Level alignment of a prototypical photocatalytic system: methanol on TiO2(110).
TL;DR: It is found that the highest occupied molecular orbital of the methoxy species is much closer to the valence band maximum, suggesting why it is more photocatalytically active than the methanol molecule.
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Quasiparticle excitations in GaAs1-xNx and AlAs1-xNx ordered alloys.
Angel Rubio,Marvin L. Cohen +1 more
TL;DR: In this article, a quasiparticle study of the fundamental excitations in ordered alloys of III-V semiconductors was performed, and it was shown that the bottom of the conduction band is dominated by nitrogen.
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Optical absorption of the blue fluorescent protein : A first-principles study
TL;DR: The power of combining time-dependent density functional calculations and optical absorption measurements to discern the relevant chemical information on the nature and state of chromopeptides is demonstrated.
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Static correlation and electron localization in molecular dimers from the self-consistent RPA and GW approximation
Maria Hellgren,Maria Hellgren,Fabio Caruso,Daniel R. Rohr,Xinguo Ren,Angel Rubio,Angel Rubio,Matthias Scheffler,Patrick Rinke,Patrick Rinke +9 more
TL;DR: In this article, the authors investigate static correlation and delocalization errors in the self-consistent GW and random-phase approximation (RPA) by studying molecular dissociation of the H2 and LiH molecules.