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Cell Molecular Dynamics for Cascade (CMDC): Molecular dynamics simulation of cascades for realistic ion energies

Jean-Paul Crocombette
Computational Materials Science, 2018, 147, pp.168-175. ⟨10.1016/j.commatsci.2018.02.008⟩
Article dans une revue cea-02443544v1
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The influence of irradiation induced vacancies on the mobility of helium in boron carbide

Kevin Gillet , Guido Roma , Jean-Paul Crocombette , Dominique Gosset
Journal of Nuclear Materials, 2018, 512, pp.288-296. ⟨10.1016/j.jnucmat.2018.10.020⟩
Article dans une revue cea-02339428v1

Role of displacement cascades in Ni clustering in a ferritic Fe-3.3at.%Ni model alloy: comparison of heavy and light particle irradiations

Lisa Belkacémi , Estelle Meslin , Brigitte Décamps , Jean-Paul Crocombette , Olivier Tissot , et al.
Scripta Materialia, 2020, 188, pp.169-173. ⟨10.1016/j.scriptamat.2020.07.031⟩
Article dans une revue cea-02932370v1

Oxygen diffusion model of the mixed (U,Pu)O2 ± x: Assessment and application

Emily Moore , Christine Guéneau , Jean-Paul Crocombette
Journal of Nuclear Materials, 2017, 485, pp.216-230. ⟨10.1016/j.jnucmat.2016.12.026⟩
Article dans une revue cea-02381332v1
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Ab-initio calculations of hydrogen diffusion coefficient in monoclinic zirconia

Orane Barbour , Jean-Paul Crocombette , Thomas Schuler , Marc Tupin
Journal of Nuclear Materials, 2020, 539, pp.152333. ⟨10.1016/j.jnucmat.2020.152333⟩
Article dans une revue cea-03169490v1
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Lattice constant in nonstoichiometric uranium dioxide from first principles

Fabien Bruneval , Michel Freyss , Jean-Paul Crocombette
Physical Review Materials, 2018, 2, pp.023801. ⟨10.1103/PhysRevMaterials.2.023801⟩
Article dans une revue cea-02063621v1
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Influence of vibrational entropy on the concentrations of oxygen interstitial clusters and uranium vacancies in non-stoichiometric UO$_2$

Aurélien Soulié , Fabien Bruneval , Mihai-Cosmin Marinica , Samuel Murphy , Jean-Paul Crocombette
Physical Review Materials, 2018, 2, pp.083607. ⟨10.1103/PhysRevMaterials.2.083607⟩
Article dans une revue cea-02340007v1

Pressure, relaxation volume, and elastic interactions in charged simulation cells

Fabien Bruneval , Céline Varvenne , Jean-Paul Crocombette , Emmanuel Clouet
Physical Review B, 2015, 91 (2), ⟨10.1103/PhysRevB.91.024107⟩
Article dans une revue cea-03188722v1
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Lattice strain in irradiated materials unveils a prevalent defect evolution mechanism

Aurélien Debelle , Jean-Paul Crocombette , Alexandre Boulle , Alain Chartier , Thomas Jourdan , et al.
Physical Review Materials, 2018, 2 (1), pp.013604. ⟨10.1103/PhysRevMaterials.2.013604⟩
Article dans une revue hal-02193081v1

Cell Molecular Dynamics for Cascades (CMDC): A new tool for cascade simulation

Jean-Paul Crocombette , Thomas Jourdan
Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms, 2015, 352, pp.9-13. ⟨10.1016/j.nimb.2014.12.009⟩
Article dans une revue cea-03190089v1

Atomistically-informed thermal glide model for edge dislocations in uranium dioxide

Aurélien Soulié , Jean-Paul Crocombette , Antoine Kraych , Frédérico Garrido , Gaël Sattonnay , et al.
Acta Materialia, 2018, 150, pp.248-261. ⟨10.1016/j.actamat.2018.03.024⟩
Article dans une revue hal-02429515v1
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How relative defect migration energies drive contrasting temperature-dependent microstructural evolution in irradiated ceramics

Aurélien Debelle , Jean-Paul Crocombette , Alexandre Boulle , Enrique Martínez , Blas Pedro Uberuaga , et al.
Physical Review Materials, 2018, 2 (8), ⟨10.1103/PhysRevMaterials.2.083605⟩
Article dans une revue hal-02193035v1
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Défauts ponctuels et irradiation dans les oxydes : simulations à l'échelle atomique (HDR)

Jean-Paul Crocombette
Physique [physics]. Université de Marne la Vallée, 2005
HDR tel-00011337v1

Effect of the variation of the electronic density of states of zirconium and tungsten on their respective thermal conductivity evolution with temperature

Jean-Paul Crocombette , Paul Notargiacomo , M-C Marinica
Journal of Physics: Condensed Matter, 2015, 27 (16), pp.165501. ⟨10.1088/0953-8984/27/16/165501⟩
Article dans une revue cea-02384785v1

Effect of disorder on the metal-insulator transition of vanadium oxides: Local versus global effects

Juan Gabriel Ramirez , Thomas Saerbeck , Siming Wang , J. Trastoy , M. Malnou , et al.
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2015, 91 (20), ⟨10.1103/PhysRevB.91.205123⟩
Article dans une revue cea-02384456v1

Nature and Behaviour of Point Defects in UO2 Based on an Experimental and Theoretical Study of Electrical and Atomic Transport Properties

Philippe Garcia , Elizabetta Pizzi , David Simeone , Gianguido Baldinozzi , David A. Andersson , et al.
Symposium HH – Advances in Materials for Nuclear Energy, Nov 2012, Boston, United States
Communication dans un congrès hal-00761368v1

X-ray diffraction study of the Y2Ti2O7 pyrochlore disordering sequence under irradiation

Soulié Aurélien , Menut Denis , Crocombette Jean-Paul , Chartier Alain , Sellami Neila , et al.
Journal of Nuclear Materials, 2016, 480, pp.314-322. ⟨10.1016/j.jnucmat.2016.08.005⟩
Article dans une revue in2p3-01389509v1
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Quick calculation of damage for ion irradiation: implementation in Iradina and comparisons to SRIM

Jean-Paul Crocombette , Christian Van Wambeke
EPJ N - Nuclear Sciences & Technologies, 2019, 5, pp.7. ⟨10.1051/epjn/2019003⟩
Article dans une revue cea-02304265v1

A defect model for UO$_{2+x}$ based on electrical conductivity and deviation from stoichiometry measurements

Philippe Garcia , Elisabetta Pizzi , Boris Dorado , David A. Andersson , Jean-Paul Crocombette , et al.
Journal of Nuclear Materials, 2017, 494, pp.461 - 472. ⟨10.1016/j.jnucmat.2017.03.033⟩
Article dans une revue hal-01614248v1

Quantitative electronic stopping power from localized basis set

Ivan Maliyov , Jean-Paul Crocombette , Fabien Bruneval
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2020, 101, pp.035136. ⟨10.1103/PhysRevB.101.035136⟩
Article dans une revue cea-02454608v1
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Analysis of strain and disordering kinetics based on combined RBS-channeling and X-ray diffraction atomic-scale modelling

Xin Jin , Alexandre Boulle , Alain Chartier , Jean-Paul Crocombette , Aurelien Debelle
Acta Materialia, 2020, 201, pp.63-71. ⟨10.1016/j.actamat.2020.09.076⟩
Article dans une revue hal-03034474v1
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Molecular dynamics simulations of high energy cascade in ordered alloys: Defect production and subcascade division

Laurence Luneville , Jean-Paul Crocombette , Laurent van Brutzel , David Simeone , Laurence Lunéville
Journal of Nuclear Materials, 2016, 474, pp.134-142. ⟨10.1016/j.jnucmat.2016.03.020⟩
Article dans une revue hal-02429493v1