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Wannier interpolation of the electron-phonon matrix elements in polar semiconductors: Polar-optical coupling in GaAs
Wannier interpolation of the electron-phonon matrix elements in polar semiconductors: Polar-optical coupling in GaAs
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Wannier interpolation of the electron-phonon matrix elements in polar semiconductors: Polar-optical coupling in GaAs

Sjakste, J. ; Vast, N. ; Calandra, M. ; Mauri, F.

Physical review. B, Condensed matter and materials physics, 2015-08, Vol.92 (5), Article 054307 [Revista revisada por pares]

American Physical Society

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Density functional theory description of hole-trapping in SiO2 : A self-interaction-corrected approach
Density functional theory description of hole-trapping in SiO2 : A self-interaction-corrected approach
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Density functional theory description of hole-trapping in SiO2 : A self-interaction-corrected approach

D'AVEZAC, Mayeul ; CALANDRA, Matteo ; MAURI, Francesco

Physical review. B, Condensed matter and materials physics, 2005-05, Vol.71 (20), p.205210.1-205210.5 [Revista revisada por pares]

Ridge, NY: American Physical Society

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Anharmonic phonon frequency shift in MgB2
Anharmonic phonon frequency shift in MgB2
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Anharmonic phonon frequency shift in MgB2

Lazzeri, Michele ; Calandra, Matteo ; Mauri, Francesco

Physical review. B, Condensed matter and materials physics, 2003-12, Vol.68 [Revista revisada por pares]

American Physical Society

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4
Electron-phonon coupling and phonon self-energy in MgB2: Interpretation of MgB2 Raman spectra
Electron-phonon coupling and phonon self-energy in MgB2: Interpretation of MgB2 Raman spectra
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Electron-phonon coupling and phonon self-energy in MgB2: Interpretation of MgB2 Raman spectra

Calandra, Matteo ; Mauri, Francesco

Physical review. B, Condensed matter and materials physics, 2006, Vol.71 [Revista revisada por pares]

American Physical Society

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5
Superconductivity from doping boron icosahedra
Superconductivity from doping boron icosahedra
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Superconductivity from doping boron icosahedra

CALANDRA, Matteo ; VAST, Nathalie ; MAURI, Francesco

Physical review. B, Condensed matter and materials physics, 2004-06, Vol.69 (22), p.224505.1-224505.5, Article 224505 [Revista revisada por pares]

Ridge, NY: American Physical Society

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6
Advanced capabilities for materials modelling with Quantum ESPRESSO
Advanced capabilities for materials modelling with Quantum ESPRESSO
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Advanced capabilities for materials modelling with Quantum ESPRESSO

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, Jr, R A ; Ferretti, A ; Floris, A ; Fratesi, G ; Fugallo, G ; Gebauer, R ; Gerstmann, U ; Giustino, F ; Gorni, T ; Jia, J ; Kawamura, M ; Ko, H-Y ; Kokalj, A ; Küçükbenli, E ; Lazzeri, M ; Marsili, M ; Marzari, N ; Mauri, F ; Nguyen, N L ; Nguyen, H-V ; Otero-de-la-Roza, A ; Paulatto, L ; Poncé, 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

Journal of physics. Condensed matter, 2017-11, Vol.29 (46), p.465901 [Revista revisada por pares]

England

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7
K-edge x-ray absorption spectra in transition-metal oxides beyond the single-particle approximation: Shake-up many-body effects
K-edge x-ray absorption spectra in transition-metal oxides beyond the single-particle approximation: Shake-up many-body effects
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K-edge x-ray absorption spectra in transition-metal oxides beyond the single-particle approximation: Shake-up many-body effects

Calandra, M. ; Rueff, J. P. ; Gougoussis, C. ; Céolin, D. ; Gorgoi, M. ; Benedetti, S. ; Torelli, P. ; Shukla, A. ; Chandesris, D. ; Brouder, Ch

Physical review. B, Condensed matter and materials physics, 2012-10, Vol.86 (16), Article 165102

American Physical Society

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8
Effects of magnetism and doping on the electron-phonon coupling in BaFe2As2
Effects of magnetism and doping on the electron-phonon coupling in BaFe2As2
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Effects of magnetism and doping on the electron-phonon coupling in BaFe2As2

Boeri, L. ; Calandra, M. ; I. Mazin, I. ; V. Dolgov, O. ; Mauri, Francesco

Physical review. B, Condensed matter and materials physics, 2010-07, Vol.82 [Revista revisada por pares]

American Physical Society

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9
X-ray magnetic and natural circular dichroism from first principles: Calculation of K - and L 1 -edge spectra
X-ray magnetic and natural circular dichroism from first principles: Calculation of K - and L 1 -edge spectra
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X-ray magnetic and natural circular dichroism from first principles: Calculation of K - and L 1 -edge spectra

Bouldi, N. ; Vollmers, N. J. ; Delpy-Laplanche, C. G. ; Joly, Y. ; Juhin, A. ; Sainctavit, Ph ; Brouder, Ch ; Calandra, M. ; Paulatto, L. ; Mauri, F. ; Gerstmann, U.

Physical review. B, 2017-08, Vol.96 (8), Article 085123 [Revista revisada por pares]

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Intrinsic charge transfer gap in NiO from Ni   K -edge x-ray absorption spectroscopy
Intrinsic charge transfer gap in NiO from Ni   K -edge x-ray absorption spectroscopy
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Intrinsic charge transfer gap in NiO from Ni   K -edge x-ray absorption spectroscopy

Gougoussis, C. ; Calandra, M. ; Seitsonen, A. ; Brouder, Ch ; Shukla, A. ; Mauri, F.

Physical review. B, Condensed matter and materials physics, 2009-01, Vol.79 (4), Article 045118 [Revista revisada por pares]

American Physical Society

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