Showing 1 - 20 results of 21 for search 'Nicola Marzari', query time: 0.05s
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1
Automated all-functionals infrared and Raman spectra by Lorenzo Bastonero, Nicola Marzari
Published 2024-03-01
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2
Emergent dual topology in the three-dimensional Kane-Mele Pt_{2}HgSe_{3} by Antimo Marrazzo, Nicola Marzari, Marco Gibertini
Published 2020-03-01
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Projectability disentanglement for accurate and automated electronic-structure Hamiltonians by Junfeng Qiao, Giovanni Pizzi, Nicola Marzari
Published 2023-11-01
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Infrared-active phonons in one-dimensional materials and their spectroscopic signatures by Norma Rivano, Nicola Marzari, Thibault Sohier
Published 2023-10-01
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Thermal conductivity of glasses: first-principles theory and applications by Michele Simoncelli, Francesco Mauri, Nicola Marzari
Published 2023-06-01
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Automated mixing of maximally localized Wannier functions into target manifolds by Junfeng Qiao, Giovanni Pizzi, Nicola Marzari
Published 2023-10-01
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Solids that are also liquids: elastic tensors of superionic materials by Giuliana Materzanini, Tommaso Chiarotti, Nicola Marzari
Published 2023-01-01
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General invariance and equilibrium conditions for lattice dynamics in 1D, 2D, and 3D materials by Changpeng Lin, Samuel Poncé, Nicola Marzari
Published 2022-11-01
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Type-I antiferromagnetic Weyl semimetal InMnTi_{2} by Davide Grassano, Luca Binci, Nicola Marzari
Published 2024-02-01
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Crossover from Boltzmann to Wigner thermal transport in thermoelectric skutterudites by Enrico Di Lucente, Michele Simoncelli, Nicola Marzari
Published 2023-08-01
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Hybridization driving distortions and multiferroicity in rare-earth nickelates by Luca Binci, Michele Kotiuga, Iurii Timrov, Nicola Marzari
Published 2023-09-01
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Phonon Self-Energy Corrections: To Screen, or Not to Screen by Jan Berges, Nina Girotto, Tim Wehling, Nicola Marzari, Samuel Poncé
Published 2023-10-01
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Self-consistent DFT+U+V study of oxygen vacancies in SrTiO_{3} by Chiara Ricca, Iurii Timrov, Matteo Cococcioni, Nicola Marzari, Ulrich Aschauer
Published 2020-06-01
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Thermodynamics and dielectric response of BaTiO3 by data-driven modeling by Lorenzo Gigli, Max Veit, Michele Kotiuga, Giovanni Pizzi, Nicola Marzari, Michele Ceriotti
Published 2022-09-01
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Microscopic picture of paraelectric perovskites from structural prototypes by Michele Kotiuga, Samed Halilov, Boris Kozinsky, Marco Fornari, Nicola Marzari, Giovanni Pizzi
Published 2022-03-01
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