フォロー
Gérald Jomard
Gérald Jomard
確認したメール アドレス: cea.fr
タイトル
引用先
引用先
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
29852009
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
8212016
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
2842008
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
2412020
Stability of oxygen point defects in by first-principles calculations: Occupation matrix control and Jahn-Teller distortion
B Dorado, G Jomard, M Freyss, M Bertolus
Physical Review B—Condensed Matter and Materials Physics 82 (3), 035114, 2010
2372010
First-principles calculations to describe zirconia pseudopolymorphs
G Jomard, T Petit, A Pasturel, L Magaud, G Kresse, J Hafner
Physical Review B 59 (6), 4044, 1999
2201999
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
1102013
Melting curve of aluminum up to 300 GPa obtained through ab initio molecular dynamics simulations
J Bouchet, F Bottin, G Jomard, G Zérah
Physical Review B—Condensed Matter and Materials Physics 80 (9), 094102, 2009
1072009
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
972009
DFT+ U investigation of charged point defects and clusters in UO2
E Vathonne, J Wiktor, M Freyss, G Jomard, M Bertolus
Journal of Physics: Condensed Matter 26 (32), 325501, 2014
872014
Full-potential calculations using the generalized-gradient corrections: structural properties of Ti, Zr and Hf under compression
G Jomard, L Magaud, A Pasturel
Philosophical Magazine B 77 (1), 67-74, 1998
681998
Location of krypton atoms in uranium dioxide
T Petit, G Jomard, C Lemaignan, B Bigot, A Pasturel
Journal of nuclear materials 275 (1), 119-123, 1999
551999
Coupled experimental and investigation of positron lifetimes in
J Wiktor, MF Barthe, G Jomard, M Torrent, M Freyss, M Bertolus
Physical Review B 90 (18), 184101, 2014
462014
Two-component density functional theory within the projector augmented-wave approach: Accurate and self-consistent computations of positron lifetimes and momentum distributions
J Wiktor, G Jomard, M Torrent
Physical Review B 92 (12), 125113, 2015
442015
Positron annihilation spectroscopy investigation of vacancy clusters in silicon carbide: Combining experiments and electronic structure calculations
J Wiktor, X Kerbiriou, G Jomard, S Esnouf, MF Barthe, M Bertolus
Physical Review B 89 (15), 155203, 2014
392014
Thermodynamic stability of PuO surfaces: Influence of electronic correlations
G Jomard, F Bottin
Physical Review B—Condensed Matter and Materials Physics 84 (19), 195469, 2011
392011
Electronic structure investigation of energetics and positron lifetimes of fully relaxed monovacancies with various charge states in 3-SiC and 6-SiC
J Wiktor, G Jomard, M Torrent, M Bertolus
Physical Review B—Condensed Matter and Materials Physics 87 (23), 235207, 2013
362013
CARACAS. An industrial model for the description of fission gas behavior in LWR-UO_2 fuel
G Jomard, C Struzik, A Boulore, P Mailhé, V Auret, R Largenton
332014
Water adsorption and dissociation on the PuO2 (1 1 0) surface
G Jomard, F Bottin, G Geneste
Journal of Nuclear Materials 451 (1-3), 28-34, 2014
332014
New Pseudophase Structure for
J Bouchet, RC Albers, MD Jones, G Jomard
Physical review letters 92 (9), 095503, 2004
332004
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