QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials P Giannozzi, S Baroni, N Bonini, M Calandra, R Car, C Cavazzoni, ...
Journal of physics: Condensed matter 21 (39), 395502, 2009
27638 2009 Advanced capabilities for materials modelling with Quantum ESPRESSO P Giannozzi, O Andreussi, T Brumme, O Bunau, MB Nardelli, M Calandra, ...
Journal of physics: Condensed matter 29 (46), 465901, 2017
6630 2017 Phonon-mediated superconductivity in graphene by lithium deposition G Profeta, M Calandra, F Mauri
Nature physics 8 (2), 131-134, 2012
542 2012 QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials G Paolo, B Stefano, B Nicola, C Matteo, C Roberto, C Carlo, C Davide, ...
J. Phys. Condens. Matter 21 (395502), 10.1088, 2009
541 2009 Colloquium : Saturation of electrical resistivityO Gunnarsson, M Calandra, JE Han
Reviews of Modern Physics 75 (4), 1085, 2003
483 2003 High-pressure hydrogen sulfide from first principles: A strongly anharmonic phonon-mediated superconductor I Errea, M Calandra, CJ Pickard, J Nelson, RJ Needs, Y Li, H Liu, Y Zhang, ...
Physical review letters 114 (15), 157004, 2015
474 2015 Exponential localization of Wannier functions in insulators C Brouder, G Panati, M Calandra, C Mourougane, N Marzari
Physical review letters 98 (4), 046402, 2007
373 2007 Anharmonic free energies and phonon dispersions from the stochastic self-consistent harmonic approximation: Application to platinum and palladium hydrides I Errea, M Calandra, F Mauri
Physical Review B 89 (6), 064302, 2014
365 2014 Theoretical Explanation of Superconductivity in M Calandra, F Mauri
Physical Review Letters 95 (23), 237002, 2005
307 2005 Chemically exfoliated single-layer MoS 2: Stability, lattice dynamics, and catalytic adsorption from first principles M Calandra
Physical Review B 88 (24), 245428, 2013
301 2013 Quantum hydrogen-bond symmetrization in the superconducting hydrogen sulfide system I Errea, M Calandra, CJ Pickard, JR Nelson, RJ Needs, Y Li, H Liu, ...
Nature 532 (7597), 81-84, 2016
290 2016 Quantum hydrogen-bond symmetrization in the superconducting hydrogen sulfide system I Errea, M Calandra, CJ Pickard, JR Nelson, RJ Needs, Y Li, H Liu, ...
Nature 532 (7597), 81-84, 2016
290 2016 Anomalous High‐Temperature Superconductivity in YH6 IA Troyan, DV Semenok, AG Kvashnin, AV Sadakov, OA Sobolevskiy, ...
Advanced Materials 33 (15), 2006832, 2021
278 2021 Quantum crystal structure in the 250-kelvin superconducting lanthanum hydride I Errea, F Belli, L Monacelli, A Sanna, T Koretsune, T Tadano, R Bianco, ...
Nature 578 (7793), 66-69, 2020
268 2020 Effect of dimensionality on the charge-density wave in few-layer 2 H-NbSe 2 M Calandra, II Mazin, F Mauri
Physical Review B 80 (24), 241108, 2009
266 2009 First-principles theory of anharmonicity and the inverse isotope effect in superconducting palladium-hydride compounds I Errea, M Calandra, F Mauri
Physical review letters 111 (17), 177002, 2013
253 2013 Density functional perturbation theory for gated two-dimensional heterostructures: Theoretical developments and application to flexural phonons in graphene T Sohier, M Calandra, F Mauri
Physical Review B 96 (7), 075448, 2017
250 2017 Numerical study of the two-dimensional Heisenberg model using a Green function Monte Carlo technique with a fixed number of walkers MC Buonaura, S Sorella
Physical Review B 57 (18), 11446, 1998
243 1998 Charge-density wave and superconducting dome in TiSe 2 from electron-phonon interaction M Calandra, F Mauri
Physical review letters 106 (19), 196406, 2011
219 2011 Electron-phonon coupling and electron self-energy in electron-doped graphene: Calculation of angular-resolved photoemission spectra M Calandra, F Mauri
Physical Review B 76 (20), 205411, 2007
215 2007