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From the 1 of 135 linked papers with an AI index.

activity
19982025
most citedQuantum ESPRESSO: a modular and open-source software project for quantum simulations of materials

29.3k citations · 47.2k across the 133 of their papers we have counts for

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Showing 2017Show all

12 papers · 1 filter

cond-mat.supr-con2017

Exchange Enhancement of the Electron-Phonon Interaction: the Case of Weakly Doped Two-Dimensional Multivalley Semiconductors

Betul Pamuk, Paolo Zoccante, Jacopo Baima +2

The effect of the exchange interaction on the vibrational properties and on the electron-phonon coupling were investigated in several recent works. In most of the case, exchange te…

cond-mat.mtrl-sci2017★ 7.7k cited

Advanced capabilities for materials modelling with Quantum ESPRESSO

P. Giannozzi, O. Andreussi, T. Brumme +47

Quantum ESPRESSO is an integrated suite of open-source computer codes for quantum simulations of materials using state-of-the art electronic-structure techniques, based on density-…

cond-mat.mtrl-sci2017★ 97 cited

Anharmonic phonon spectra of PbTe and SnTe in the self-consistent harmonic approximation

Guilherme A. Ribeiro, Lorenzo Paulatto, Raffaello Bianco +3

At room temperature, PbTe and SnTe are efficient thermoelectrics with a cubic structure. At low temperature, SnTe undergoes a ferroelectric transition with a critical temperature s…

cond-mat.mtrl-sci2017★ 75 cited

Flat Electronic Bands in Long Sequences of Rhombohedral-stacked Multilayer Graphene

Hugo Henck, Jose Avila, Zeineb Ben Aziza +15

The crystallographic stacking order in multilayer graphene plays an important role in determining its electronic properties. It has been predicted that a rhombohedral (ABC) stackin…

cond-mat.supr-con2017★ 8 cited

High- superconductivity in weakly electron-doped HfNCl

Betül Pamuk, Francesco Mauri, Matteo Calandra

We investigate the magnetic and superconducting properties in electron-doped LiHfNCl. HfNCl is a band insulator that undergoes an insulator to superconductor transition upon do…

cond-mat.mtrl-sci2017★ 35 cited

The Raman fingerprint of rhombohedral graphite

Abderrezak Torche, Francesco Mauri, Jean-Christophe Charlier +1

Multi-layer graphene with rhombohedral stacking is a promising carbon phase possibly displaying correlated states like magnetism or superconductivity due to the occurrence of a fla…