Kimika Teorikoa: Conceptos y Simulaciones en (Foto)Quimica, (Bio)Polimeros y Materiales Avanzados
University of Hamburg
Hamburgo, AlemaniaPublicaciones en colaboración con investigadores/as de University of Hamburg (5)
2023
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Chiral-Induced Spin Selectivity and Non-equilibrium Spin Accumulation in Molecules and Interfaces: A First-Principles Study
Journal of Physical Chemistry Letters, Vol. 14, Núm. 3, pp. 694-701
2022
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A Chirality-Based Quantum Leap
ACS Nano, Vol. 16, Núm. 4, pp. 4989-5035
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Common Trends of Chiral Induced Spin Selectivity and Optical Dichroism with Varying Helix Pitch: A First-Principles Study
Israel Journal of Chemistry, Vol. 62, Núm. 11-12
2020
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Influence of Electronic Structure Modeling and Junction Structure on First-Principles Chiral Induced Spin Selectivity
Journal of Chemical Theory and Computation, Vol. 16, Núm. 12, pp. 7357-7371
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Insight into the Origin of Chiral-Induced Spin Selectivity from a Symmetry Analysis of Electronic Transmission
Journal of Chemical Theory and Computation, Vol. 16, Núm. 5, pp. 2914-2929