Sfoglia per Autore
Formation of hot-electron ensembles quasiequilibrated in momentum space by ultrafast momentum scattering of highly excited hot electrons photoinjected into the Γ valley of GaAs
2016-01-01 Tanimura, H.; Kanasaki, J.; Tanimura, K.; Sjakste, J.; Vast, N.; Calandra, M.; Mauri, F.
High- Tc superconductivity in weakly electron-doped HfNCl
2017-01-01 Pamuk, B.; Mauri, F.; Calandra, M.
Erratum: Two-dimensional Fröhlich interaction in transition-metal dichalcogenide monolayers: Theoretical modeling and first-principles calculations (Physical Review B (2016) 94 (085415) DOI: 10.1103/PhysRevB.94.085415)
2017-01-01 Sohier, Thibault; Calandra, Matteo; Mauri, Francesco
Anharmonicity and the isotope effect in superconducting lithium at high pressures: A first-principles approach
2017-01-01 Borinaga, M.; Aseginolaza, U.; Errea, I.; Calandra, M.; Mauri, F.; Bergara, A.
First-principles determination of the Raman fingerprint of rhombohedral graphite
2017-01-01 Torche, Abderrezak; Mauri, Francesco; Charlier, Jean-Christophe; Calandra, Matteo
Density functional perturbation theory for gated two-dimensional heterostructures: Theoretical developments and application to flexural phonons in graphene
2017-01-01 Sohier, Thibault; Calandra, Matteo; Mauri, Francesco
X-ray magnetic and natural circular dichroism from first principles: Calculation of K - And L1 -edge spectra
2017-01-01 Bouldi, N.; Vollmers, N. J.; Delpy-Laplanche, C. G.; Joly, Y.; Juhin, A.; Sainctavit, P.; Brouder, C.; Calandra, M.; Paulatto, L.; Mauri, F.; Gerstmann, U.
Effect of electron doping on lattice instabilities in single-layer 1H-TaS2
2017-01-01 Albertini, O. R.; Liu, A. Y.; Calandra, M.
Magnetic gap opening in rhombohedral-stacked multilayer graphene from first principles
2017-01-01 Pamuk, B.; Baima, J.; Mauri, F.; Calandra, M.
Advanced capabilities for materials modelling with Quantum ESPRESSO
2017-01-01 Giannozzi, P.; Andreussi, O.; Brumme, T.; Bunau, O.; Buongiorno Nardelli, M.; Calandra, M.; Car, R.; Cavazzoni, C.; Ceresoli, D.; Cococcioni, M.; Colonna, N.; Carnimeo, I.; Dal Corso, A.; De Gironcoli, S.; Delugas, P.; Distasio, R. A.; Ferretti, A.; Floris, A.; Fratesi, G.; Fugallo, G.; Gebauer, R.; Gerstmann, U.; Giustino, F.; Gorni, T.; Jia, J.; Kawamura, M.; H. -Y., Ko; Kokalj, A.; Kucukbenli, E.; Lazzeri, M.; Marsili, M.; Marzari, N.; Mauri, F.; Nguyen, N. L.; Nguyen, H. -V.; Otero-De-La-Roza, A.; Paulatto, L.; Ponce, S.; Rocca, D.; Sabatini, R.; Santra, B.; Schlipf, M.; Seitsonen, A. P.; Smogunov, A.; Timrov, I.; Thonhauser, T.; Umari, P.; Vast, N.; Wu, X.; Baroni, S.
Critical Role of the Exchange Interaction for the Electronic Structure and Charge-Density-Wave Formation in TiSe2
2017-01-01 Hellgren, M.; Baima, J.; Bianco, R.; Calandra, M.; Mauri, F.; Wirtz, L.
Breakdown of Optical Phonons' Splitting in Two-Dimensional Materials
2017-01-01 Sohier, T.; Gibertini, M.; Calandra, M.; Mauri, F.; Marzari, N.
Second-order structural phase transitions, free energy curvature, and temperature-dependent anharmonic phonons in the self-consistent harmonic approximation: Theory and stochastic implementation
2017-01-01 Bianco, R.; Errea, I.; Paulatto, L.; Calandra, M.; Mauri, F.
Inelastic X ray scattering under pressure to probe the quantum phase transition in the transition metal dichalcogenides
2017-01-01 Leroux, Maxime; Errea, Ion; Tacon, Mathieu Le; Souliou, Sophia-Michaela; Garbarino, Gaston; Cario, Laurent; Bosak, Alexey; Mauri, Francesco; Calandra, Matteo; Rodière, Pierre
High-pressure phase diagram of hydrogen and deuterium sulfides from first principles: Structural and vibrational properties including quantum and anharmonic effects
2018-01-01 Bianco, R.; Errea, I.; Calandra, M.; Mauri, F.
Chiral Spin Texture in the Charge-Density-Wave Phase of the Correlated Metallic Pb/Si (111) Monolayer
2018-01-01 Tresca, C.; Brun, C.; Bilgeri, T.; Menard, G.; Cherkez, V.; Federicci, R.; Longo, D.; Debontridder, F.; D'Angelo, M.; Roditchev, D.; Profeta, G.; Calandra, M.; Cren, T.
Strong anharmonicity in the phonon spectra of PbTe and SnTe from first principles
2018-01-01 Ribeiro, Guilherme A. S.; Paulatto, Lorenzo; Bianco, Raffaello; Errea, Ion; Mauri, Francesco; Calandra, Matteo
Pressure and stress tensor of complex anharmonic crystals within the stochastic self-consistent harmonic approximation
2018-01-01 Monacelli, L.; Errea, I.; Calandra, M.; Mauri, F.
Flat electronic bands in long sequences of rhombohedral-stacked graphene
2018-01-01 Henck, H.; Avila, J.; Ben Aziza, Z.; Pierucci, D.; Baima, J.; Pamuk, B.; Chaste, J.; Utt, D.; Bartos, M.; Nogajewski, K.; Piot, B. A.; Orlita, M.; Potemski, M.; Calandra, M.; Asensio, M. C.; Mauri, F.; Faugeras, C.; Ouerghi, A.
Phonon-Assisted Magnetic Mott-Insulating State in the Charge Density Wave Phase of Single-Layer 1T-NbSe2
2018-01-01 Calandra Buonaura, Matteo
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