Céline Léonard
Publications
Publications
Ni/Mn order in LiMn2-xNixO4 (0.38 ≤ x ≤ 0.50) positive electrode material: a gradual temperature-driven sublattice disorder through antiphase boundary defectsISICXXI: 21st International Symposium on Intercalation Compounds, Jun 2023, Nancy, France |
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Characterization of scattering and condensation process of gaseous methane at the quartz interface and liquid methane interfaceEuropean Conference on Non-equilibrium Gas Flows - NEGF23, Mar 2023, Eindhoven, Netherlands. pp.4 |
Numerical modeling of dry reforming of methane for hydrogen production: reviewFrench-Singaporean research network programme on Renewable Energy (SINERGIE), Nov 2023, Singapore, Singapore |
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Theoretical developments of new gas detection devicesCapteurs pour l’étude et l’amélioration de l’environnement, Nov 2021, Champs sur Marne, France |
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Développement multi-échelle d’un dispositif de détection et de suivi de petites molécules polluantes dans l’air ambiantFUTURE Days, Dec 2020, Champs sur Marne, France |
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Développements théoriques de nouveaux dispositifs de détection de gazJTMS 2020 : Journées "Théorie, Modélisation et Simulation", Nov 2020, Visioconférence, France |
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Theoretical developments of new gas detection devicesMSSC2019 – Ab initio Modelling in Solid State Chemistry, Sep 2019, Londres, United Kingdom |
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Des calculs ab-initio aux méthodes des milieux continus : Modélisation des phénomènes d’interface pour le transportRencontres prospectives 2019 du RFCT : Modélisations multi-échelles, Jun 2019, Nantes, France |
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Développements théoriques de nouveaux dispositifs de détection de gazJTMS 2019 : Journées "Théorie, Modélisation et Simulation", Jun 2019, Paris, France |
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Direct method of identifying slip and jump coefficients for gas flows using Molecular Dynamics.31st International Symposium on Rarefied Gas Dynamics, Jul 2018, Glasgow, United Kingdom |
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Construction of non-parametric collision model for graphitic wallsNEGF'18, 3rd European Conference on Non-Equilibrium Gas Flows 2018, Feb 2018, Strasbourg, France |
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Examples of high quality Potential Energy Surfaces for Dynamics ApplicationsMOLIM Workshop on Intermolecular Interactions, Oct 2017, Santiago de Compostela, Spain |
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Strain induced friction between graphite and molecular liquidInterPore2017 : 9th International Conference on Porous Media and Annual Meeting, May 2017, Rotterdam, Netherlands |
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Examples of high quality Potential Energy Surfaces for Dynamics ApplicationsQuantum Dynamics with the Multi-Configuration Time-Dependent Hartree (MCTDH) method : future and perspectives, Sep 2017, Orsay, France |
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VELOCITY SLIP AND TEMPERATURE JUMP FOR GAS FLOWS PAST ANISOTROPIC SURFACES: ANALYTICAL DERIVATION AND NUMERICAL SIMULATIONInternational Conference on Nanochannels, Microchannels, and Minichannels, Jul 2016, Washington, United States |
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Multi-step multi-scale ab-initio-assisted modelling: gas flows between solid wallsCOST MOLIM working group 3 meeting, Mar 2016, Bratislava, Slovakia |
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French network of theoretical chemistryAtomic and molecular calculation softwares on massivey parallel machines: present and future, Jun 2015, TGCC, Bruyères-le-Châtel, France |
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French network of theoretical chemistry5th Chinese-French Workshop in Theoretical Chemistry, May 2015, Strasbourg, France |
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Studies of the Interactions of He and Ar with a Gold SurfaceHelium-mediated Synthesis, Soft-landing and Spectroscopy of Metal Nanoparticles on Surfaces HeSSSMe 2014, Oct 2014, Madrid, Spain |
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Multiscale study of gas slip flows in nanochannels4th ASME Micro/Nanoscale Heat & Mass Transfer International Conference (MNHMT-13), Dec 2013, Hong Kong, Hong Kong SAR China. ⟨10.1115/1.4030205⟩ |
The Renner-Teller effect in floppy chain tetra-atomic moleculesCODECS - Workshop, 2013, Madrid, Spain |
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Réseau de Chimie Théorique29èmes JIREC sur Enseigner une chimie économe et créatrice, 2013, Marne la Vallée, France |
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Effet Renner-Teller dans les molécules tetra-atomiques linéaires et linéaires-pliéesColloque commun de la division de Physique Atomique et Moléculaire et Optique de la SFP et des Journées de Spectroscopie Moléculaire, Jul 2012, Metz, France |
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Temperature, surface roughness and anisotropy effects on the tangential momentum accomodation coefficient between Pt(100) AND Ar3 rd European Conference on Microfluidics - Microfluidics 2012 - Heidelberg, December 3-5, 2012, Dec 2012, Germany. pp.1 |
Tangential Momentum Accommodation Coefficient of Argon on Pt(111): a Multi-Scale StudyFirst International Conference on Computational Science and Engineering, Dec 2011, Vietnam |
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Ro-vibrational spectroscopy in tetra-atomic Renner-Teller moleculesThird French Chinese Workshop in Theoretical Chemistry, Oct 2011, La Colle-sur-Loup, France |
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Ab initio rovibrational spectroscopy in tetra-atomic moleculesAction CM1002 Meeting, TheTIS 2001, Theoretical Tools for In Silico Spectroscopy, Apr 2011, Paris, France. pp.1 |
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Probabilités de transitions radiatives dans les niveaux rovibroniques de CO2+Colloque commun de la division de Physique Atomique et Moléculaire et Optique de la SFP et des Journées de Spectroscopie Moléculaire (PAMO-JSM), Jun 2010, Orsay, France. pp.1 |
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Theoretical study of the predissociation of the A2Π states of ZnF including quasi-diabatisation of the spin-orbit couplingInternational Meeting on Atomic and Molecular Physics and Chemistry, Jun 2010, Madrid, Spain. pp.1 |
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Modélisation de l'interaction électron-molécule dans le système [C,N,O]11ème Rencontre des Chimistes Théoriciens Français, Jun 2008, Dinard, France. pp.1 |
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Ro-vibrational spectroscopy in tetra-atomic Renner-Teller moleculesThe 4th Sino-French Workshop on Molecular Spectroscopy, Dynamics and Quantum Control, Oct 2008, Hefei, China |
Structural study and diffusion of lithium in materials for LiyMn1.5Ni0.5O4 battery cathodesRencontres ThéMoSiA-RCTF-2024, Jun 2024, Rouen, France |
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DETERMINATION OF RESONANCE CHARACTERISTICS BY PRONY ANALYSIS OF AN AUTOCORRELATION FUNCTION.Workshop High Dimensional Quantum Dynamics 2014, Sep 2014, Colmar, France |
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Determination of resonance characteristics by Prony analysis of an autocorrelation function.CODECS 2013 Workshop. San Lorenzo de el Escorial, Madrid, 18th –22nd April, 2013, Apr 2013, Madrid, Spain |
Coefficients d'accommodation et glissement dans les écoulements gazeux : étude par dynamique moléculaire.2013 |