ABINIT: First-principles approach to material and nanosystem properties X Gonze, B Amadon, PM Anglade, JM Beuken, F Bottin, P Boulanger, ... Computer Physics Communications 180 (12), 2582-2615, 2009 | 2983 | 2009 |
Recent developments in the ABINIT software package X Gonze, F Jollet, FA Araujo, D Adams, B Amadon, T Applencourt, ... Computer physics communications 205, 106-131, 2016 | 816 | 2016 |
The ABINIT project: Impact, environment and recent developments X Gonze, B Amadon, G Antonius, F Arnardi, L Baguet, JM Beuken, ... Computer Physics Communications 248, 107042, 2020 | 524 | 2020 |
calculations of the ground state and metastable states of uranium dioxide B Dorado, B Amadon, M Freyss, M Bertolus Physical Review B—Condensed Matter and Materials Physics 79 (23), 235125, 2009 | 443 | 2009 |
Plane-wave based electronic structure calculations for correlated materials using dynamical mean-field theory and projected local orbitals B Amadon, F Lechermann, A Georges, F Jollet, TO Wehling, ... Physical Review B—Condensed Matter and Materials Physics 77 (20), 205112, 2008 | 285 | 2008 |
Structural, thermodynamic, and electronic properties of plutonium oxides from first principles G Jomard, B Amadon, F Bottin, M Torrent Physical Review B—Condensed Matter and Materials Physics 78 (7), 075125, 2008 | 284 | 2008 |
ABINIT: Overview and focus on selected capabilities AH Romero, DC Allan, B Amadon, G Antonius, T Applencourt, L Baguet, ... The Journal of chemical physics 152 (12), 2020 | 238 | 2020 |
and cerium: calculations of ground-state parameters B Amadon, F Jollet, M Torrent Physical Review B—Condensed Matter and Materials Physics 77 (15), 155104, 2008 | 236 | 2008 |
Self-consistency over the charge density in dynamical mean-field theory: A linear muffin-tin implementation and some physical implications LV Pourovskii, B Amadon, S Biermann, A Georges Physical Review B—Condensed Matter and Materials Physics 76 (23), 235101, 2007 | 202 | 2007 |
The Transition of Cerium Is Entropy Driven B Amadon, S Biermann, A Georges, F Aryasetiawan Physical review letters 96 (6), 066402, 2006 | 197 | 2006 |
Advances in first-principles modelling of point defects in UO2: f electron correlations and the issue of local energy minima B Dorado, M Freyss, B Amadon, M Bertolus, G Jomard, P Garcia Journal of Physics: Condensed Matter 25 (33), 333201, 2013 | 110 | 2013 |
A self-consistent DFT+ DMFT scheme in the projector augmented wave method: applications to cerium, Ce2O3 and Pu2O3 with the Hubbard I solver and comparison to DFT+ U B Amadon Journal of Physics: Condensed Matter 24 (7), 075604, 2012 | 102 | 2012 |
Structural properties and quasiparticle energies of cubic SrO, MgO and SrTiO3 G Cappellini, S Bouette-Russo, B Amadon, C Noguera, F Finocchi Journal of Physics: Condensed Matter 12 (15), 3671, 2000 | 102 | 2000 |
Hybrid functional for correlated electrons in the projector augmented-wave formalism: Study of multiple minima for actinide oxides F Jollet, G Jomard, B Amadon, JP Crocombette, D Torumba Physical Review B—Condensed Matter and Materials Physics 80 (23), 235109, 2009 | 97 | 2009 |
Screened Coulomb interaction calculations: cRPA implementation and applications to dynamical screening and self-consistency in uranium dioxide and cerium B Amadon, T Applencourt, F Bruneval Physical Review B 89 (12), 125110, 2014 | 78 | 2014 |
Diffusionless Phase Transition in Polycrystalline and Single-Crystal Cerium F Decremps, L Belhadi, DL Farber, KT Moore, F Occelli, M Gauthier, ... Physical Review Letters 106 (6), 065701, 2011 | 74 | 2011 |
Thermodynamics of the - transition in cerium from first principles J Bieder, B Amadon Physical Review B 89 (19), 195132, 2014 | 56 | 2014 |
DFT+ study of self-trapping, trapping, and mobility of oxygen-type hole polarons in barium stannate G Geneste, B Amadon, M Torrent, G Dezanneau Physical Review B 96 (13), 134123, 2017 | 50 | 2017 |
First-principles DFT+ DMFT calculations of structural properties of actinides: Role of Hund's exchange, spin-orbit coupling, and crystal structure B Amadon Physical Review B 94 (11), 115148, 2016 | 49 | 2016 |
Mechanism for the phase transition in iron B Dupé, B Amadon, YP Pellegrini, C Denoual Physical Review B—Condensed Matter and Materials Physics 87 (2), 024103, 2013 | 43 | 2013 |