Liste des publications issues de travaux ayant bénéficié des ressources du mésocentre

2021

Katherine M Xiang; David M Nataf; E Athanassoula; Nadia L Zakamska; Kate Rowlands; Karen Masters; Amelia Fraser-McKelvie; Niv Drory; Katarina Kraljic

Buckling Bars in Nearly Face-on Galaxies Observed with MaNGA Article de journal

Dans: The Astrophysical Journal, 909 (2), p. 125, 2021, ISSN: 1538-4357.

Résumé | Liens | BibTeX

Christophe Brouzet; Raphaël Guiné; Marie-Julie Dalbe; Benjamin Favier; Nicolas Vandenberghe; Emmanuel Villermaux; Gautier Verhille

Laboratory model for plastic fragmentation in the turbulent ocean Article de journal

Dans: Phys. Rev. Fluids, 6 , p. 024601, 2021.

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Jeroen P J Bruekers; Matthijs A Hellinghuizen; Nicolas Vanthuyne; Paul Tinnemans; Pieter J Gilissen; Wybren Jan Buma; Jean-Valère Naubron; Jeanne Crassous; Johannes A A W Elemans; Roeland J M Nolte

Front Cover: Allosteric Guest Binding in Chiral Zirconium(IV) Double Decker Porphyrin Cages (Eur. J. Org. Chem. 4/2021) Article de journal

Dans: European Journal of Organic Chemistry, 2021 (4), p. 512-512, 2021.

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Shang-Gui Cai; Johan Degrigny; Jean-François Boussuge; Pierre Sagaut

Coupling of turbulence wall models and immersed boundaries on Cartesian grids Article de journal

Dans: Journal of Computational Physics, 429 , p. 109995, 2021, ISSN: 0021-9991.

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Philippe Maugis; Damien Connétable; Paul Eyméoud

Stability of Zener order in martensite: an atomistic evidence Article de journal

Dans: Scripta Materialia, 194 , p. 113632, 2021, ISSN: 1359-6462.

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M Tayyab; S Zhao; Pierre Boivin

Lattice-Boltzmann modeling of a turbulent bluff-body stabilized flame Article de journal

Dans: Physics of Fluids, 33 (3), p. 031701, 2021.

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D Mandal; Y Elskens; X Leoncini; N Lemoine; F Doveil

Sticky islands in stochastic webs and anomalous chaotic cross-field particle transport by E×B electron drift instability Article de journal

Dans: Chaos, Solitons & Fractals, 145 , p. 110810, 2021, ISSN: 0960-0779.

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Guochao Gao; Paul Cristini; Nathalie Favretto-Cristini; Carole Deumié

On the reflection of time-domain acoustic spherical waves by a sinusoidal diffraction grating Article de journal

Dans: Acta Acust., 5 , p. 6, 2021.

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Oleg Bessonov; Sofiane Meradji

Parallel modeling of wildfires using efficient solvers for ill-conditioned linear systems Article de journal

Dans: The Journal of Supercomputing, 2021.

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58 Entrées « 1 de 2 »

2020

A Gallo; A Sepetys; Y Marandet; H Bufferand; G Ciraolo; N Fedorczak; S Brezinsek; J Bucalossi; J Coenen; F Clairet; Y Corre; C Desgranges; P Devynck; J Gaspar; R Guirlet; J Gunn; C C Klepper; J -Y Pascal; P Tamain; E Tsitrone; E A Unterberg; WEST the team

Interpretative transport modeling of the WEST boundary plasma: main plasma and light impurities Article de journal

Dans: Nuclear Fusion, 60 (12), p. 126048, 2020.

Résumé | Liens | BibTeX

Thomas Lacroix; Arturo Nunez-Castineyra; Martin Stref; Julien Lavalle; Emmanuel Nezri

Predicting the dark matter velocity distribution in galactic structures: tests against hydrodynamic cosmological simulations Article de journal

Dans: Journal of Cosmology and Astroparticle Physics, 2020 (10), p. 031–031, 2020.

Résumé | Liens | BibTeX

Jing Wang; E Athanassoula; Si-Yue Yu; Christian Wolf; Li Shao; Hua Gao; T H Randriamampandry

Suppressed or Enhanced Central Star Formation Rates in Late-type Barred Galaxies Article de journal

Dans: The Astrophysical Journal, 893 (1), p. 19, 2020, ISSN: 1538-4357.

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Paul G Chen; J M Lyu; M Jaeger; M Leonetti

Shape transition and hydrodynamics of vesicles in tube flow Article de journal

Dans: Phys. Rev. Fluids, 5 , p. 043602, 2020.

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Daphné Lemasquerier; Giulio Facchini; Benjamin Favier ; Michael Le Bars

Remote determination of the shape of Jupiter’s vortices from laboratory experiments Article de journal

Dans: Nature Physics, 2020.

Résumé | Liens | BibTeX

P Léard; B Favier; P Le Gal; M Le Bars

Coupled convection and internal gravity waves excited in water around its density maximum at 4°C Article de journal

Dans: Phys. Rev. Fluids, 5 , p. 024801, 2020.

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F Nespoli; P Tamain; N Fedorczak; D Galassi; Y Marandet

A new mechanism for filament disconnection at the X-point: poloidal shear in radial E texttimes B velocity Article de journal

Dans: Nuclear Fusion, 60 (4), p. 046002, 2020.

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Joackim Bernier; Michel Mehrenberger

LONG-TIME BEHAVIOR OF SECOND ORDER LINEARIZED VLASOV-POISSON EQUATIONS NEAR A HOMOGENEOUS EQUILIBRIUM Article de journal

Dans: KINETIC AND RELATED MODELS, 13 (1), p. 129-168, 2020, ISSN: 1937-5093.

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Patrick Maget; Judith Frank; Timothee Nicolas; Olivier Agullo; Xavier Garbet; Hinrich Lutjens

Natural poloidal asymmetry and neoclassical transport of impurities in tokamak plasmas Article de journal

Dans: PLASMA PHYSICS AND CONTROLLED FUSION, 62 (2), 2020, ISSN: 0741-3335.

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Maria‐Andrea Mroginski; Suliman Adam; Gil Amoyal; Avishai Barnoy; Ana‐Nicoleta Bondar; Veniamin Borin; Jonathan Church; Tatiana Domratcheva; Bernd Ensing; Francesca Fanelli; Nicolas Ferré; Ofer Filiba; Laura Pedraza-González; Ronald González; Cristina González‐Espinoza; Rajiv Kar; Lukas Kemmler; Seung Kim; Jacob Kongsted; Igor Schapiro

Frontiers in Multiscale Modeling of Photoreceptor Proteins Article de journal

Dans: Photochemistry and Photobiology, 2020.

Résumé | Liens | BibTeX

Kankoé Sallah; Roch Giorgi; El-Hadj Ba; Martine Piarroux; Renaud Piarroux; Badara Cissé; Jean Gaudart

Targeting Malaria Hotspots to Reduce Transmission Incidence in Senegal Article de journal

Dans: International Journal of Environmental Research and Public Health, 18 , p. 76, 2020.

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Yasaman Karami; Paul Saighi; Rémy Vanderhaegen; Denis Gerlier; Sonia Longhi; Elodie Laine; Alessandra Carbone

Predicting substitutions to modulate disorder and stability in coiled-coils Article de journal

Dans: BMC Bioinformatics, 21 , 2020.

Résumé | Liens | BibTeX

P Boulet; Marie-Christine Record

Theoretical Investigations of the BaRh2Ge4X6 (X = S, Se, Te) Compounds Article de journal

Dans: Energies, 13 , p. 6434, 2020.

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Shao-Long Guo; Yong-Liang Feng; Pierre Sagaut

Improved standard thermal lattice Boltzmann model with hybrid recursive regularization for compressible laminar and turbulent flows Article de journal

Dans: Physics of Fluids, 32 , 2020.

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Amédée Renand; Iñaki Cervera-Marzal; Laurine Gil; Chuang Dong; Alexandra Garcia; Erwan Kervagoret; Hélène Aublé; Sarah Habes; Caroline Chevalier; Fabienne Vavasseur; Béatrice Clémenceau; Anaïs Cardon; Jean-Paul Judor; Jean-François Mosnier; Florence Tanné; David-Axel Laplaud; Sophie Brouard; Jérôme Gournay; Pierre Milpied; Sophie Conchon

Integrative molecular profiling of autoreactive CD4 T cells in autoimmune hepatitis Article de journal

Dans: Journal of Hepatology, 2020.

Résumé | Liens | BibTeX

Léa Pousse-Beltran; Anne Socquet; Lucilla Benedetti; Marie-Pierre Doin; Magali Rizza; Nicola D'Agostino

Localized Afterslip at Geometrical Complexities Revealed by InSAR After the 2016 Central Italy Seismic Sequence Article de journal

Dans: Journal of Geophysical Research: Solid Earth, 125 (11), p. e2019JB019065, 2020, (e2019JB019065 2019JB019065).

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Hailong Yang; Pascal Boulet; Marie-Christine Record

Thermoelectric Properties of Sb-S System Compounds from DFT Calculations Article de journal

Dans: Materials, 13 (21), p. 4707, 2020.

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Victor Boutin; Angelo Franciosini; Franck Ruffier; Laurent Perrinet

Effect of Top-Down Connections in Hierarchical Sparse Coding Article de journal

Dans: Neural Computation, 32 (11), p. 2279-2309, 2020, (PMID: 32946716).

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Robert Darlin Mba; Juste Aristide Goungounga; Nathalie Graffeo; Roch Giorgi

Correcting inaccurate background mortality in excess hazard models through breakpoints Article de journal

Dans: BMC Medical Research Methodology, 20 (1), p. 268, 2020.

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Kai Zhang; Aymeric Lamorlette

An extensive numerical study of the burning dynamics of wildland fuel using proposed configuration space Article de journal

Dans: International Journal of Heat and Mass Transfer, 160 , p. 120174, 2020, ISSN: 0017-9310.

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S Guo; Y Feng; J Jacob; F Renard; P Sagaut

An efficient lattice Boltzmann method for compressible aerodynamics on D3Q19 lattice Article de journal

Dans: Journal of Computational Physics, 418 , p. 109570, 2020, ISSN: 0021-9991.

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Fábris Kossoski; Mario Barbatti

Nonadiabatic dynamics in multidimensional complex potential energy surfaces Article de journal

Dans: Chem. Sci., 11 , p. 9827-9835, 2020.

Résumé | Liens | BibTeX

Jiangkun Ouyang; Anne Swartjes; Marc Geerts; Pieter J Gilissen; D Wang; Paula C P Teeuwen; paul Tinnemans; Nicolas Vanthuyne; Sara Chentouf; Floris P J T Rutjes; J -V Naubron; Jeanne Crassous; Johannes A A W Elemans; R Nolte

Absolute configuration and host-guest binding of chiral porphyrin-cages by a combined chiroptical and theoretical approach Article de journal

Dans: Nature Communications, 11 (1), p. 4776, 2020.

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G Giorgiani; H Bufferand; F Schwander; E Serre; P Tamain

A high-order non field-aligned approach for the discretization of strongly anisotropic diffusion operators in magnetic fusion Article de journal

Dans: Computer Physics Communications, 254 , p. 107375, 2020, ISSN: 0010-4655.

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G Giorgiani; H Bufferand; F Schwander; E Serre; P Tamain

A high-order non field-aligned approach for the discretization of strongly anisotropic diffusion operators in magnetic fusion Article de journal

Dans: Computer Physics Communications, 254 , p. 107375, 2020, ISSN: 0010-4655.

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Xi Deng; Pierre Boivin

Diffuse interface modelling of reactive multi-phase flows applied to a sub-critical cryogenic jet Article de journal

Dans: Applied Mathematical Modelling, 84 , p. 405-424, 2020, ISSN: 0307-904X.

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Marcel Krug; Maximilian Wagner; Tobias A Schaub; Wen-Shan Zhang; Christoph M Schüßlbauer; Johannes D R Ascherl; Peter W Münich; Rasmus R Schröder; Franziska Gröhn; Pavlo O Dral; Mario Barbatti; Dirk M Guldi; Milan Kivala

The Impact of Aggregation on the Photophysics of Spiro-Bridged Heterotriangulenes Article de journal

Dans: Angewandte Chemie International Edition, 59 (37), p. 16233-16240, 2020.

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Katsunori Mizuno; Paul Cristini; Dimitri Komatitsch; Yann Capdeville

Numerical and Experimental Study of Wave Propagation in Water-Saturated Granular Media Using Effective Method Theories and a Full-Wave Numerical Simulation Article de journal

Dans: IEEE Journal of Oceanic Engineering, 45 (3), p. 772 - 785, 2020.

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Y Feng; S Guo; J Jacob; P Sagaut

Grid refinement in the three-dimensional hybrid recursive regularized lattice Boltzmann method for compressible aerodynamics Article de journal

Dans: Physical Review E , 101 (6), p. 063302, 2020.

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Hailong Yang; Pascal Boulet; Marie-Christine Record

New insight into the structure-property relationships from chemical bonding analysis: Application to thermoelectric materials Article de journal

Dans: Journal of Solid State Chemistry, 286 , p. 121266, 2020, ISSN: 0022-4596.

Résumé | Liens | BibTeX

Hailong Yang; Pascal Boulet; Marie-Christine Record

A rapid method for analyzing the chemical bond from energy densities calculations at the bond critical point Article de journal

Dans: Computational and Theoretical Chemistry, 1178 , p. 112784, 2020, ISSN: 2210-271X.

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T Cartier-Michaud; D Galassi; Ph Ghendrih; P Tamain; F Schwander; E Serre

A posteriori error estimate in fluid simulations of turbulent edge plasmas for magnetic fusion in tokamak using the data mining iPoPe method Article de journal

Dans: Physics of Plasmas, 2020.

Résumé | Liens | BibTeX

Farhan Siddique; Mario Barbatti; Zhonghua Cui; Hans Lischka; Adélia Aquino

Nonadiabatic Dynamics of Charge-Transfer States Using the Anthracene-Tetracyanoethylene Complex as Prototype Article de journal

Dans: Journal of Physical Chemistry A, 124 (17), p. 3347-3357, 2020.

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Shuming Bai; Ritam Mansour; Ljiljana Stojanovi'c; Josene Toldo; Mario Barbatti

On the Origin of the Shift Between Vertical Excitation and Band Maximum in Molecular Photoabsorption Article de journal

Dans: Journal of Molecular Modeling, 26 (5), 2020.

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Pingping Jiang; Marie-Christine Record; Pascal Boulet

First-principles calculations on CuInSe2/AlP heterostructures Article de journal

Dans: J. Mater. Chem. C, 8 , p. 4732-4742, 2020.

Résumé | Liens | BibTeX

Hans Lischka; Ron Shepard; Thomas Mueller; Péter Szalay; Russell Pitzer; Adélia Aquino; Mayzza Nascimento; Mario Barbatti; Lachlan Belcher; Jean Blaudeau; Itamar Jr; Scott Brozell; Emily Carter; Anita Das; Gergely Gidofalvi; Leticia González; William Hase; Gary Kedziora; Miklos Kertesz; Zhiyong Zhang

The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry Article de journal

Dans: The Journal of Chemical Physics, 152 , p. 134110, 2020.

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Zeyd Benseghier; Pablo Cuéllar; Li-Hua Luu; Stéphane Bonelli; Pierre Philippe

A parallel GPU-based computational framework for the micromechanical analysis of geotechnical and erosion problems Article de journal

Dans: Computers and Geotechnics, 120 , p. 103404, 2020, ISSN: 0266-352X.

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Hung Truong; Thomas Engels; Dmitry Kolomenskiy; Kai Schneider

A mass-spring fluid-structure interaction solver: Application to flexible revolving wings Article de journal

Dans: Computers & Fluids, 200 , p. 104426, 2020, ISSN: 0045-7930.

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Thomas Engels; Henja-Niniane Wehmann; Fritz-Olaf Lehmann

Three-dimensional wing structure attenuates aerodynamic efficiency in flapping fly wings Article de journal

Dans: Journal of The Royal Society Interface, 17 , p. 20190804, 2020.

Résumé | Liens | BibTeX

Noudjoud Attaf; Iñaki Cervera-Marzal; Chuang Dong; Laurine Gil; Amédée Renand; Lionel Spinelli; Pierre Milpied

Corrigendum: FB5P-seq: FACS-Based 5-Prime End Single-Cell RNA-seq for Integrative Analysis of Transcriptome and Antigen Receptor Repertoire in B and T Cells Article de journal

Dans: Frontiers in Immunology, 11 , p. 2047, 2020.

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Kai Zhang; Salman Verma; Arnaud Trouvé; Aymeric Lamorlette

A study of the canopy effect on fire regime transition using an objectively defined Byram convective number Article de journal

Dans: Fire Safety Journal, 112 , p. 102950, 2020, ISSN: 0379-7112.

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Bjørn Ursin; Nathalie Favretto-Cristini; Paul Cristini

Amplitude and phase changes for reflected and transmitted waves from a curved interface in anisotropic media Article de journal

Dans: Geophysical Journal International, 224 (1), p. 719-737, 2020, ISSN: 0956-540X.

Résumé | Liens | BibTeX

Stéphane Ayache; Ronan Sicre; Thierry Arti`eres

Transfer Learning by Weighting Convolution Inproceedings

Dans: International Joint Conference on Neural Networks (IJCNN), Glasgow, United Kingdom, 2020.

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Akrem Sellami; François-Xavier Dupé; Bastien Cagna; Hachem Kadri; Stéphane Ayache; Thierry Artières; Sylvain Takerkart

Mapping individual differences in cortical architecture using multi-view representation learning Divers

2020.

Résumé | Liens | BibTeX

Benjamin Kadoch; Wouter Bos; Kai Schneider

Efficiency of laminar and turbulent mixing in wall-bounded flows Article de journal

Dans: Physical Review E, 101 , 2020.

Résumé | Liens | BibTeX

Benjamin Favier; Edgar Knobloch

Robust wall states in rapidly rotating Rayleigh–Bénard convection Article de journal

Dans: Journal of Fluid Mechanics, 895 , p. R1, 2020.

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Karno Schwinn; Nicolas Ferré; Miquel Huix-Rotllant

UV-visible absorption spectrum of FAD and its reduced forms embedded in a cryptochrome protein Article de journal

Dans: Phys. Chem. Chem. Phys., 22 , p. 12447-12455, 2020.

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Karno Schwinn; Nicolas Ferré; Miquel Huix-Rotllant

Efficient Analytic Second Derivative of Electrostatic Embedding QM/MM Energy: Normal Mode Analysis of Plant Cryptochrome Article de journal

Dans: Journal of Chemical Theory and Computation, 16 (6), p. 3816-3824, 2020.

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Y Wang; E Athanassoula; S Mao

Basis function expansions for galactic dynamics: Spherical versus cylindrical coordinates Article de journal

Dans: A&A, 639 , p. A38, 2020.

Résumé | Liens | BibTeX

Paul Eyméoud; Philippe Maugis

Magnetic behavior of transition metal solutes in α-iron: A classification Article de journal

Dans: Journal of Magnetism and Magnetic Materials, 513 , p. 167223, 2020, ISSN: 0304-8853.

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58 Entrées « 1 de 2 »

2019

Marianthi Karageorgi; Simon C Groen; Fidan Sumbul; Julianne N Pelaez; Kirsten I Verster; Jessica M Aguilar; Amy P Hastings; Susan L Bernstein; Teruyuki Matsunaga; Michael Astourian; Geno Guerra; Felix Rico; Susanne Dobler; Anurag A Agrawal; Noah K Whiteman

Genome editing retraces the evolution of toxin resistance in the monarch butterfly Article de journal

Dans: NATURE, 574 (7778), p. 409+, 2019, ISSN: 0028-0836.

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Flavio Ronetti; Luca Vannucci; Dario Ferraro; Thibaut Jonckheere; Jér^ome Rech; Thierry Martin; Maura Sassetti

Hong-Ou-Mandel heat noise in the quantum Hall regime Article de journal

Dans: Phys. Rev. B, 99 , p. 205406, 2019.

Liens | BibTeX

Pingping Jiang; Pascal Boulet; Marie-Christine Record

A DFT study of the electronic, optical and topological properties of free and biaxially strained CuIn1-xAlxSe2 Article de journal

Dans: JOURNAL OF MATERIALS CHEMISTRY C, 7 (19), p. 5803-5815, 2019, ISSN: 2050-7526.

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S Baschetti; H Bufferand; G Ciraolo; N Fedorczak; P Ghendrih; P Tamain; E Serre; EUROfusion MST1 Team; TCV Team

A kappa - epsilon model for plasma anomalous transport in tokamaks: closure via the scaling of the global confinement Article de journal

Dans: NUCLEAR MATERIALS AND ENERGY, 19 , p. 200-204, 2019.

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J Denis; J Bucalossi; G Ciraolo; E A Hodille; B Pegourie; H Bufferand; C Grisolia; T Loarer; Y Marandet; E Serre; JET Contributors

Dynamic modelling of local fuel inventory and desorption in the whole tokamak vacuum vessel for auto-consistent plasma-wall interaction simulations Article de journal

Dans: NUCLEAR MATERIALS AND ENERGY, 19 , p. 550-557, 2019.

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G Giorgiani; H Bufferand; G Ciraolo; E Serre; P Tamain

A magnetic-field independent approach for strongly anisotropic equations arising plasma-edge transport simulations Article de journal

Dans: NUCLEAR MATERIALS AND ENERGY, 19 , p. 340-345, 2019.

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B Favier; J Purseed; L Duchemin

Rayleigh–Bénard convection with a melting boundary Article de journal

Dans: Journal of Fluid Mechanics, 858 , p. 437–473, 2019.

Liens | BibTeX

Hassan Denawi; Mathieu Abel; Roland Hayn

Magnetic Polymer Chains of Transition Metal Atoms and Zwitterionic Quinone Article de journal

Dans: The Journal of Physical Chemistry C, 123 (7), p. 4582-4589, 2019.

Liens | BibTeX

M Valentinuzzi; Y Marandet; H Bufferand; G Ciraolo; P Tamain

Two-phases hybrid model for neutrals Article de journal

Dans: Nuclear Materials and Energy, 18 , p. 41 - 45, 2019, ISSN: 2352-1791.

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D M Fan; Y Marandet; P Tamain; H Bufferand; G Ciraolo; Ph. Ghendrih; E Serre

Effect of turbulent fluctuations on neutral particles transport with the TOKAM3X-EIRENE turbulence code Article de journal

Dans: Nuclear Materials and Energy, 18 , p. 105 - 110, 2019, ISSN: 2352-1791.

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F Nespoli; H Bufferand; M Valentinuzzi; N Fedorczak; G Ciraolo; E Serre; Y Marandet; R Maurizio; De H Oliveira; B Labit; M Komm; M Faitsch; S Elmore

Application of a two-fluid two-point model to SolEdge2D-EIRENE simulations of TCV H-mode plasma Article de journal

Dans: Nuclear Materials and Energy, 18 , p. 29 - 34, 2019, ISSN: 2352-1791.

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H Bufferand; P Tamain; S Baschetti; J Bucalossi; G Ciraolo; N Fedorczak; Ph. Ghendrih; F Nespoli; F Schwander; E Serre; Y Marandet

Three-dimensional modelling of edge multi-component plasma taking into account realistic wall geometry Article de journal

Dans: Nuclear Materials and Energy, 18 , p. 82 - 86, 2019, ISSN: 2352-1791.

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Cédric Maury; Teresa Bravo; Daniel Mazzoni

The use of microperforations to attenuate the cavity pressure fluctuations induced by a low-speed flow Article de journal

Dans: Journal of Sound and Vibration, 439 , p. 1 - 16, 2019, ISSN: 0022-460X.

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Christine D Wilson; Laura C Parker; Ryan Chown; Niu Li; Cheng Li; Houjun Mo; E Athanassoula; Lin Lin; Ting Xiao

Linking bar- and interaction-driven molecular gas concentration with centrally enhanced star formation in EDGE–CALIFA galaxies Article de journal

Dans: Monthly Notices of the Royal Astronomical Society, 484 (4), p. 5192-5211, 2019, ISSN: 0035-8711.

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Ran Liu; Xing Gao; Mario Barbatti; Jun Jiang; Guozhen Zhang

Promoting Intersystem Crossing of a Fluorescent Molecule via Single Functional Group Modification Article de journal

Dans: The Journal of Physical Chemistry Letters, 10 (6), p. 1388-1393, 2019.

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Gessenildo Pereira Rodrigues; Thayana Maria Lopes de Lima; Railton Barbosa de Andrade; Elizete Ventura; Silmar Andrade do Monte; Mario Barbatti

Photoinduced Formation of H-Bonded Ion Pair in HCFC-133a Article de journal

Dans: The Journal of Physical Chemistry A, 123 (10), p. 1953-1961, 2019, (PMID: 30786711).

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Shuming Bai; Mario Barbatti

Mechanism of Spin-Exchange Internal Conversion: Practical Proxies for Diabatic and Nonadiabatic Couplings Article de journal

Dans: Journal of Chemical Theory and Computation, 15 (3), p. 1503-1513, 2019, (PMID: 30735372).

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Pierre Thureau; Simone Sturniolo; Miri Zilka; Fabio Ziarelli; Stéphane Viel; Jonathan R Yates; Giulia Mollica

Reducing the computational cost of NMR crystallography of organic powders at natural isotopic abundance with the help of 13C-13C dipolar couplings Article de journal

Dans: Magnetic Resonance in Chemistry, 57 (5), p. 256-264, 2019.

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2018

Je K š; Y Marandet; H Bufferand; J P Gunn; H J van der Meiden; G Ciraolo

Studying divertor relevant plasmas in the Pilot-PSI linear plasma device: experiments versus modelling Article de journal

Dans: Plasma Physics and Controlled Fusion, 60 (12), p. 125009, 2018.

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Falahati Konstantin; Tamura Hiroyuki; Burghardt Irene; Huix-Rotllant Miquel

Ultrafast carbon monoxide photolysis and heme spin-crossover in myoglobin via nonadiabatic quantum dynamics Livre

2018.

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Xiaoliang He; Sourabh Apte; Kai Schneider; Benjamin Kadoch

Angular multiscale statistics of turbulence in a porous bed Article de journal

Dans: Phys. Rev. Fluids, 3 , p. 084501, 2018.

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S Cabanes; B Favier; M Le Bars

Some statistical properties of three-dimensional zonostrophic turbulence Article de journal

Dans: Geophysical and Astrophysical Fluid Dynamics, 112 (3), p. 207-221, 2018.

Liens | BibTeX

Sandeep K Reddy; Benjamin Favier; Michael Le Bars

Turbulent Kinematic Dynamos in Ellipsoids Driven by Mechanical Forcing Article de journal

Dans: Geophysical Research Letters, 45 (4), p. 1741-1750, 2018.

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Thomas Le Reun; Benjamin Favier; Michael Le Bars

Parametric instability and wave turbulence driven by tidal excitation of internal waves Article de journal

Dans: Journal of Fluid Mechanics, 840 , p. 498–529, 2018.

Liens | BibTeX

Yongliang Feng; Muhammad Tayyab; Pierre Boivin

A Lattice-Boltzmann model for low-Mach reactive flows Article de journal

Dans: Combustion and Flame, 196 , p. 249 - 254, 2018, ISSN: 0010-2180.

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Elisa Pieri; Vincent Ledentu; Miquel Huix-Rotllant; Nicolas Ferré

Sampling the protonation states: the pH-dependent UV absorption spectrum of a polypeptide dyad Article de journal

Dans: Phys. Chem. Chem. Phys., 20 , p. 23252-23261, 2018.

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Cristina García-Iriepa; Pauline Gosset; Romain Berraud-Pache; Madjid Zemmouche; Grégory Taupier; Kokou Dodzi Dorkenoo; Pascal Didier; Jérémie Léonard; Nicolas Ferré; Isabelle Navizet

Simulation and Analysis of the Spectroscopic Properties of Oxyluciferin and Its Analogues in Water Article de journal

Dans: Journal of Chemical Theory and Computation, 14 (4), p. 2117-2126, 2018, (PMID: 29509419).

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Grégoire David; Frank Wennmohs; Frank Neese; Nicolas Ferré

Chemical Tuning of Magnetic Exchange Couplings Using Broken-Symmetry Density Functional Theory Article de journal

Dans: Inorganic Chemistry, 57 (20), p. 12769-12776, 2018.

Résumé | Liens | BibTeX

Transport and Mixing Induced by Beating Cilia in Human Airways Article de journal

Dans: Frontiers in Physiology, 9 , p. 161, 2018, ISSN: 1664-042X.

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Nicolas Cavassilas; Demetrio Logoteta; Youseung Lee; Fabienne Michelini; Michel Lannoo; Marc Bescond; Mathieu Luisier

Dual-Gated WTe2/MoSe2 van der Waals Tandem Solar Cells Article de journal

Dans: The Journal of Physical Chemistry C, 122 (50), p. 28545-28549, 2018.

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Alexis Bottero; Paul Cristini; Dimitri Komatitsch; Quentin Brissaud

Broadband transmission losses and time dispersion maps from time-domain numerical simulations in ocean acoustics Article de journal

Dans: Journal of the Acoustical Society of America, 144 (3), p. EL222 - EL228, 2018.

Liens | BibTeX

M L M Rocco; M Häming; C E V de Moura; M Barbatti; A B Rocha; A Schöll; E Umbach

High-Resolution Near-Edge X-ray Absorption Fine Structure Study of Condensed Polyacenes Article de journal

Dans: The Journal of Physical Chemistry C, 122 (50), p. 28692-28701, 2018.

Résumé | Liens | BibTeX

Deniz Tuna; Lasse Spörkel; Mario Barbatti; Walter Thiel

Nonadiabatic dynamics simulations of photoexcited urocanic acid Article de journal

Dans: Chemical Physics, 515 , p. 521 - 534, 2018, ISSN: 0301-0104, (Ultrafast Photoinduced Processes in Polyatomic Molecules:Electronic Structure, Dynamics and Spectroscopy (Dedicated to Wolfgang Domcke on the occasion of his 70th birthday)).

Résumé | Liens | BibTeX

Pavlo O Dral; Mario Barbatti; Walter Thiel

Nonadiabatic Excited-State Dynamics with Machine Learning Article de journal

Dans: The Journal of Physical Chemistry Letters, 9 (19), p. 5660-5663, 2018, (PMID: 30200766).

Résumé | Liens | BibTeX

A Mohamadzade; S Bai; M Barbatti; S Ullrich

Intersystem crossing dynamics in singly substituted thiouracil studied by time-resolved photoelectron spectroscopy: Micro-environmental effects due to sulfur position Article de journal

Dans: Chemical Physics, 515 , p. 572-579, 2018.

Liens | BibTeX

Vanessa C de Medeiros; Railton B de Andrade; Gessenildo P. Rodrigues; Glauco F Bauerfeldt; Elizete Ventura; Mario Barbatti; Silmar A do Monte

Photochemistry of CF3Cl: Quenching of Charged Fragments Is Caused by Nonadiabatic Effects Article de journal

Dans: Journal of Chemical Theory and Computation, 14 (9), p. 4844-4855, 2018, (PMID: 30080978).

Résumé | Liens | BibTeX

Li-li Jiang; Dan Luo; Xiong Lu; Qin-yong Zhang; Fang-gong Cai; Jun Chen

Comparative Study on Chemical Reduction of Free-standing Flexible GO Films and Their Cyclic Voltammetry Performance Article de journal

Dans: Colloids and Surfaces A: Physicochemical and Engineering Aspects, 555 , 2018.

Liens | BibTeX

Hans Lischka; Dana Nachtigallová; Adélia J A Aquino; Péter G Szalay; Felix Plasser; Francisco B C Machado; Mario Barbatti

Multireference Approaches for Excited States of Molecules Article de journal

Dans: Chemical Reviews, 118 (15), p. 7293-7361, 2018, (PMID: 30040389).

Résumé | Liens | BibTeX

Shuming Bai; Mario Barbatti

Mechanism of enhanced triplet decay of thionucleobase by glycosylation and rate-modulating strategies Article de journal

Dans: Phys. Chem. Chem. Phys., 20 , p. 16428-16436, 2018.

Résumé | Liens | BibTeX

Fábris Kossoski; Mario Barbatti

Nuclear Ensemble Approach with Importance Sampling Article de journal

Dans: Journal of Chemical Theory and Computation, 14 (6), p. 3173-3183, 2018, (PMID: 29694040).

Résumé | Liens | BibTeX

Rachel Crespo-Otero; Mario Barbatti

Recent Advances and Perspectives on Nonadiabatic Mixed Quantum–Classical Dynamics Article de journal

Dans: Chemical Reviews, 118 (15), p. 7026-7068, 2018, (PMID: 29767966).

Résumé | Liens | BibTeX

M L M Rocco; M Häming; C E V de Moura; M Barbatti; A B Rocha; A Schöll; E Umbach

High-Resolution Near-Edge X-ray Absorption Fine Structure Study of Condensed Polyacenes Article de journal

Dans: The Journal of Physical Chemistry C, 122 (50), p. 28692-28701, 2018.

Résumé | Liens | BibTeX

Hans Lischka; Mario Barbatti; Farhan Siddique; Anita Das; Adelia J A Aquino

The effect of hydrogen bonding on the nonadiabatic dynamics of a thymine-water cluster Article de journal

Dans: Chemical Physics, 515 , p. 472 - 479, 2018, ISSN: 0301-0104, (Ultrafast Photoinduced Processes in Polyatomic Molecules:Electronic Structure, Dynamics and Spectroscopy (Dedicated to Wolfgang Domcke on the occasion of his 70th birthday)).

Résumé | Liens | BibTeX

Konstantin Falahati; Carsten Hamerla; Miquel Huix-Rotllant; Irene Burghardt

Ultrafast photochemistry of free-base porphyrin: a theoretical investigation of B → Q internal conversion mediated by dark states Article de journal

Dans: Phys. Chem. Chem. Phys., 20 , p. 12483-12492, 2018.

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Nicolas Frangieh; Dominique Morvan; Sofiane Meradji; G ACCARY; O Bessonov

Numerical simulation of grassland fires behavior using an implicit physical multiphase model Article de journal

Dans: Fire Safety Journal, 102 , p. 37-47, 2018.

Liens | BibTeX

Dominique Morvan; Gilbert Accary; Sofiane Meradji; Nicolas Frangieh; Oleg BESSONOV

A 3D physical model to study the behavior of vegetation fires at laboratory scale Article de journal

Dans: Fire Safety Journal, 101 , p. 39-52, 2018.

Liens | BibTeX

Dmytro Kandaskalov; Philippe Maugis

Thermodynamic stabilities in the Fe-Fe16C2 system: Influence of carbon-carbon interactions studied by DFT Article de journal

Dans: Computational Materials Science, 150 , p. 524 - 534, 2018, ISSN: 0927-0256.

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2017

A Pivano; V O Dolocan

Systematic motion of magnetic domain walls in notched nanowires under ultrashort current pulses Article de journal

Dans: Phys. Rev. B, 96 , p. 224431, 2017.

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L -A Couston; D Lecoanet; B Favier; M Le Bars

Dynamics of mixed convectivechar21stably-stratified fluids Article de journal

Dans: Phys. Rev. Fluids, 2 , p. 094804, 2017.

Résumé | Liens | BibTeX

Thomas Le Reun; Benjamin Favier; Adrian J Barker; Michael Le Bars

Inertial Wave Turbulence Driven by Elliptical Instability Article de journal

Dans: Phys. Rev. Lett., 119 , p. 034502, 2017.

Résumé | Liens | BibTeX

Simon Cabanes, Jonathan Aurnou, Benjamin Favier & Michael Le Bars

A laboratory model for deep-seated jets on the gas giants Article de journal

Dans: Nature Physics, 2017.

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P. Tamain; C. Colin; L. Colas; C. Baudoin; G. Ciraolo; R. Futtersack; D. Galassi; Ph Ghendrih; N. Nace; F. Schwander; E. Serre

Numerical analysis of the impact of an RF sheath on the Scrape-Off Layer in 2D and 3D turbulence simulations Article de journal

Dans: Nuclear Materials and Energy, p. -, 2017, ISSN: 2352-1791.

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H. Bufferand; C. Baudoin; J. Bucalossi; G. Ciraolo; J. Denis; N. Fedorczak; D. Galassi; Ph. Ghendrih; R. Leybros; Y. Marandet; N. Mellet; J. Morales; N. Nace; E. Serre; P. Tamain; M. Valentinuzzi

Implementation of drift velocities and currents in SOLEDGE2D–EIRENE Article de journal

Dans: Nuclear Materials and Energy, p. -, 2017, ISSN: 2352-1791.

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G. Ciraolo; H. Bufferand; J. Bucalossi; Ph. Ghendrih; P. Tamain; Y. Marandet; M. Valentinuzzi; J. Denis; N. Fedorczak; E. Hodille; N. Mellet; B. Pegourie; C. Grisolia; C. Bourdelle; E. Tsitrone; D. Galassi; R. Leybros; G. Giorgiani; E. Serre

H-mode WEST tungsten divertor operation: deuterium and nitrogen seeded simulations with SOLEDGE2D-EIRENE Article de journal

Dans: Nuclear Materials and Energy, p. -, 2017, ISSN: 2352-1791.

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Athanassoula, E.; Rodionov, S. A.; Prantzos, N.

Metallicity-dependent kinematics and morphology of the Milky Way bulge Article de journal

Dans: Monthly Notices of the Royal Astronomical Society: Letters, 467 (1), p. L46, 2017.

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Gao, Xing; Bai, Shuming; Fazzi, Daniele; Niehaus, Thomas; Barbatti, Mario; Thiel, Walter

Evaluation of Spin-Orbit Couplings with Linear-Response Time-Dependent Density Functional Methods Article de journal

Dans: Journal of Chemical Theory and Computation, 13 (2), p. 515-524, 2017, (PMID: 27959528).

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Dmytro Kandaskalov; Philippe Maugis

A first-principle study of the structural, elastic, lattice dynamical and thermodynamic properties of and phases Article de journal

Dans: Computational Materials Science, 128 , p. 278 - 286, 2017, ISSN: 0927-0256.

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Bilel Sanhaji

Testing for Nonlinearity in Conditional Covariances Article de journal

Dans: 2017, ISSN: 21946507.

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E Constant; J Favier; M Meldi; P Meliga; E Serre

An immersed boundary method in OpenFOAM : Verification and validation Article de journal

Dans: Computers & Fluids, 157 , p. 55 - 72, 2017, ISSN: 0045-7930.

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P Manas; Y Camenen; S Benkadda; H Weisen; C Angioni; F J Casson; C Giroud; M Gelfusa; M Maslov

Gyrokinetic modeling of impurity peaking in JET H-mode plasmas Article de journal

Dans: Physics Of Plasmas, 24 (6), p. 12. 062511, 2017.

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P Migliano; D Zarzoso; F J Artola; Y Camenen; X Garbet

An improved approximation for the analytical treatment of the local linear gyro-kinetic plasma dispersion relation in toroidal geometry Article de journal

Dans: Plasma Physics and Controlled Fusion, 59 (9), p. 095004, 2017.

Résumé | Liens | BibTeX

M Muraglia; O Agullo; A Poyé; S Benkadda; N Dubuit; X Garbet; A Sen

Amplification of a turbulence driven seed magnetic island by bootstrap current Article de journal

Dans: Nuclear Fusion, 57 (7), p. 072010, 2017.

Résumé | Liens | BibTeX

O Agullo; M Muraglia; S Benkadda; A Poyé; N Dubuit; X Garbet; A Sen

Nonlinear dynamics of turbulence driven magnetic islands. II. Numerical simulations Article de journal

Dans: Physics of Plasmas, 24 (4), p. 042309, 2017.

Liens | BibTeX

O Agullo; M Muraglia; S Benkadda; A Poyé; N Dubuit; X Garbet; A Sen

Nonlinear dynamics of turbulence driven magnetic islands. I. Theoretical aspects Article de journal

Dans: Physics of Plasmas, 24 (4), p. 042308, 2017.

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Michael Stenrup; Elisa Pieri; Vincent Ledentu; Nicolas Ferre

pH-Dependent absorption spectrum of a protein: a minimal electrostatic model of Anabaena sensory rhodopsin Article de journal

Dans: Phys. Chem. Chem. Phys., 19 , p. 14073-14084, 2017.

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A M Grannan; B Favier; M Le Bars; J M Aurnou

Tidally forced turbulence in planetary interiors Article de journal

Dans: Geophysical Journal International, 208 (3), p. 1690-1703, 2017.

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Simon Cabanes; Jonathan M Aurnou; Benjamin Favier; Michael Le Bars

A laboratory model for deep-seated jets on the gas giants Article de journal

Dans: Nature Physics, 2017.

Liens | BibTeX

O Février; P Maget; H Lütjens; P Beyer

Comparison of magnetic island stabilization strategies from magneto-hydrodynamic simulations Article de journal

Dans: Plasma Physics and Controlled Fusion, 59 (4), p. 044002, 2017.

Résumé | Liens | BibTeX

O A. Bessonov

Analysis of mixed convection in the Czochralski model in a wide range of Prandtl numbers Article de journal

Dans: Fluid Dynamics, 52 , p. 375-387, 2017.

Résumé | Liens | BibTeX

Oleg Bessonov

Technological Aspects of the Hybrid Parallelization with OpenMP and MPI Inproceedings

Dans: Malyshkin, Victor (Ed.): Parallel Computing Technologies, p. 101–113, Springer International Publishing, Cham, 2017, ISBN: 978-3-319-62932-2.

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Patrick Maget; Fabien Widmer; Olivier Février; Xavier Garbet; Hinrich Lütjens

Stabilization of a magnetic island by localized heating in a tokamak with stiff temperature profile Dépubli

2017, (working paper or preprint).

Résumé | Liens | BibTeX

Benjamin Kadoch; Wouter Bos; Kai Schneider

Directional change of fluid particles in two-dimensional turbulence and of football players Article de journal

Dans: Physical Review Fluids, 2 (6), p. 064604, 2017.

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D Galassi; P Tamain; C Baudoin; H Bufferand; G Ciraolo; N Fedorczak; Ph. Ghendrih; N Nace; E Serre

Flux expansion effect on turbulent transport in 3D global simulations Article de journal

Dans: Nuclear Materials and Energy, 12 , p. 953 - 958, 2017, ISSN: 2352-1791, (Proceedings of the 22nd International Conference on Plasma Surface Interactions 2016, 22nd PSI).

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Umberto D'Ortona; Nathalie Thomas; Richard M Lueptow

Axial segregation in spherical and cylindrical rotating tumblers Article de journal

Dans: EPJ Web of Conferences, 140 , p. 03011, 2017.

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Ljiljana Stojanović; Saadullah G Aziz; Rifaat H Hilal; Felix Plasser; Thomas A Niehaus; Mario Barbatti

Nonadiabatic Dynamics of Cycloparaphenylenes with TD-DFTB Surface Hopping Article de journal

Dans: Journal of Chemical Theory and Computation, 13 (12), p. 5846-5860, 2017, (PMID: 29140693).

Résumé | Liens | BibTeX

Shuming Bai; Mario Barbatti

Spatial Factors for Triplet Fusion Reaction of Singlet Oxygen Photosensitization Article de journal

Dans: The Journal of Physical Chemistry Letters, 8 (21), p. 5456-5460, 2017, (PMID: 29058918).

Résumé | Liens | BibTeX

Shuming Bai; Mario Barbatti

Divide-to-Conquer: A Kinetic Model for Singlet Oxygen Photosensitization Article de journal

Dans: Journal of Chemical Theory and Computation, 13 (11), p. 5528-5538, 2017, (PMID: 28953379).

Résumé | Liens | BibTeX

Daniele Fazzi; Mario Barbatti; Walter Thiel

Hot and Cold Charge-Transfer Mechanisms in Organic Photovoltaics: Insights into the Excited States of Donor/Acceptor Interfaces Article de journal

Dans: The Journal of Physical Chemistry Letters, 8 (19), p. 4727-4734, 2017, (PMID: 28903560).

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Josene M Toldo; Mario Barbatti; Paulo F B Goncalves

A three-state model for the photo-Fries rearrangement Article de journal

Dans: Phys. Chem. Chem. Phys., 19 , p. 19103-19108, 2017.

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Claudia Climent; Mario Barbatti; Michael O Wolf; Christopher J Bardeen; David Casanova

The photophysics of naphthalene dimers controlled by sulfur bridge oxidation Article de journal

Dans: Chem. Sci., 8 , p. 4941-4950, 2017.

Résumé | Liens | BibTeX

Shuming Bai; Mario Barbatti

On the decay of the triplet state of thionucleobases Article de journal

Dans: Phys. Chem. Chem. Phys., 19 , p. 12674-12682, 2017.

Résumé | Liens | BibTeX

Joanna Jankowska; Mario Barbatti; Joanna Sadlej; Andrzej L Sobolewski

Tailoring the Schiff base photoswitching - a non-adiabatic molecular dynamics study of substituent effect on excited state proton transfer Article de journal

Dans: Phys. Chem. Chem. Phys., 19 , p. 5318-5325, 2017.

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2016

S. A. Rodionov, E. Athanassoula; N. Peschken

Forming disk galaxies in major mergers II. Article de journal

Dans: A&A , 600 , 2016.

Résumé | Liens | BibTeX

Meradji S., Accary G., Morvan D., Bessonov O., Fougére D.

Numerical Simulation of Grassland-Fires Behavior Using Firestar 3D Model Article de journal

Dans: In Proceedings Topical Problems of Fluid Mechanics , p. 129-140, 2016, ISBN: 978-80-87012-58-1.

Résumé | Liens | BibTeX

Jauzac, Eckert, et al.

The extraordinary amount of substructure in the Hubble Frontier Fields cluster Abell 2744 Article de journal

Dans: p. 3876-3893, 2016.

Résumé | Liens | BibTeX

B. Kadoch, T. Reimann, K. Schneider, & M. Schäfer

Comparison of a spectral method With volume penalization and a finite volume method with body fitted grids for turbulent flows Article de journal

Dans: Computers & Fluids, 133 , p. 140-150, 2016.

Résumé | Liens | BibTeX

Pivano A.; Dolocan V. O.

Chaotic dynamics of magnetic domain walls in nanowires Article de journal

Dans: Phys. Rev. B, 93 , p. 144410, 2016.

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Camenen, Y.; Casson, F. J.; Manas, P.; Peeters, A. G.

Interplay between toroidal rotation and flow shear in turbulence stabilisation Article de journal

Dans: Physics of Plasmas, 23 (2), 2016.

Liens | BibTeX

F Riva; C Colin; J Denis; L Easy; I Furno; J Madsen; F Militello; V Naulin; A H Nielsen; J M B Olsen; J T Omotani; J J Rasmussen; P Ricci; E Serre; P Tamain; C Theiler

Blob dynamics in the TORPEX experiment: a multi-code validation Article de journal

Dans: Plasma Physics and Controlled Fusion, 58 (4), p. 044005, 2016.

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Jauzac, M.; Richard, J.; Limousin, M.; Knowles, K.; Mahler, G.; Smith, G. P.; Kneib, J.-P.; Jullo, E.; Natarajan, P.; Ebeling, H.; Atek, H.; Clément, B.; Eckert, D.; Egami, E.; Massey, R.; Rexroth, M.

Hubble Frontier Fields: predictions for the return of SN Refsdal with the MUSE and GMOS spectrographs Article de journal

Dans: Monthly Notices of the Royal Astronomical Society, 457 (2), p. 2029-2042, 2016.

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Miquel Huix-Rotllant; Irene Burghardt; Nicolas Ferré

Population of triplet states in acetophenone: A quantum dynamics perspective Article de journal

Dans: Comptes Rendus Chimie, p. -, 2016, ISSN: 1631-0748.

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O Février; P Maget; H Lütjens; J F Luciani; J Decker; G Giruzzi; M Reich; P Beyer; E Lazzaro; S Nowak; the ASDEX Upgrade team

First principles fluid modelling of magnetic island stabilization by electron cyclotron current drive (ECCD) Article de journal

Dans: Plasma Physics and Controlled Fusion, 58 (4), p. 045015, 2016.

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Engels, T.; Kolomenskiy, D.; Schneider, K.; Lehmann, F.-O.; Sesterhenn, J.

Bumblebee Flight in Heavy Turbulence Article de journal

Dans: Phys. Rev. Lett., 116 , p. 028103, 2016.

Liens | BibTeX

Cartier-Michaud, T.; Ghendrih, P.; Sarazin, Y.; Abiteboul, J.; Bufferand, H.; Dif-Pradalier, G.; Garbet, X.; Grandgirard, V.; Latu, G.; Norscini, C.; Passeron, C.; Tamain, P.

Projection on Proper elements for code control: Verification, numerical convergence, and reduced models. Application to plasma turbulence simulations Article de journal

Dans: Physics of Plasmas, 23 (2), 2016.

Liens | BibTeX

S Pamela; T Eich; L Frassinetti; B Sieglin; S Saarelma; G Huijsmans; M Hoelzl; M Becoulet; F Orain; S Devaux; I Chapman; I Lupelli; E Solano; JET Contributors

Non-linear MHD simulations of ELMs in JET and quantitative comparisons to experiments Article de journal

Dans: Plasma Physics and Controlled Fusion, 58 (1), p. 014026, 2016.

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R. Aganetti; A. Lamorlette; E. Guilbert; D. Morvan; G.R. Thorpe

Advection and the self-heating of organic porous media Article de journal

Dans: International Journal of Heat and Mass Transfer, 93 , p. 1150 - 1158, 2016, ISSN: 0017-9310.

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M. El Houssami; J.C. Thomas; A. Lamorlette; D. Morvan; M. Chaos; R. Hadden; A. Simeoni

Experimental and numerical studies characterizing the burning dynamics of wildland fuels Article de journal

Dans: Combustion and Flame, 168 , p. 113 - 126, 2016, ISSN: 0010-2180.

Résumé | Liens | BibTeX

Wilmer Arbelo-González; Rachel Crespo-Otero; Mario Barbatti

Steady and time-resolved photoelectron spectra based on nuclear ensembles Article de journal

Dans: Journal of Chemical Theory and Computation, 0 (ja), p. null, 2016, (PMID: 27588827).

Résumé | Liens | BibTeX

Ivana Antol; Zoran Glasovac; Davor Margetić; Rachel Crespo-Otero; Mario Barbatti

Insights on the Auxochromic Properties of the Guanidinium Group Article de journal

Dans: The Journal of Physical Chemistry A, 0 (0), p. null, 2016, (PMID: 27556411).

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Shuming Bai; Mario Barbatti

Why Replacing Different Oxygens of Thymine with Sulfur Causes Distinct Absorption and Intersystem Crossing Article de journal

Dans: The Journal of Physical Chemistry A, 120 (32), p. 6342-6350, 2016, (PMID: 27454198).

Résumé | Liens | BibTeX

Daniele Fazzi; Mario Barbatti; Walter Thiel

Unveiling the Role of Hot Charge-Transfer States in Molecular Aggregates via Nonadiabatic Dynamics Article de journal

Dans: Journal of the American Chemical Society, 138 (13), p. 4502-4511, 2016, (PMID: 26967020).

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Xie Zhinan; Matzen René; Cristini Paul; Komatitsch Dimitri; Martin Roland

A perfectly matched layer for fluid-solid problems: Application to ocean-acoustics simulations with solid ocean bottoms Article de journal

Dans: The Journal of the Acoustical Society of America, 140 (1), 2016.

Liens | BibTeX

P. Tamain; H. Bufferand; G. Ciraolo; C. Colin; D. Galassi; Ph. Ghendrih; F. Schwander; E. Serre

The TOKAM3X code for edge turbulence fluid simulations of tokamak plasmas in versatile magnetic geometries Article de journal

Dans: Journal of Computational Physics, 321 , p. 606 - 623, 2016, ISSN: 0021-9991.

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Futtersack, R.; Colin, C.; Tamain, P.; Ciraolo, G.; Ghendrih, Ph.; Marandet, Y.; Schwander, F.; Serre, E.

First Principle Modelling of Interplay between Langmuir Probes and Plasma Turbulence Article de journal

Dans: Contributions to Plasma Physics, 56 (6-8), p. 575–580, 2016, ISSN: 1521-3986.

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Tamain, P.; Bufferand, H.; Carbajal, L.; Marandet, Y.; Baudoin, C.; Ciraolo, G.; Colin, C.; Futtersack, R.; Galassi, D.; Ghendrih, P.; Nace, N.; Schwander, F.; Serre, E.

Interplay between Plasma Turbulence and Particle Injection in 3D Global Simulations Article de journal

Dans: Contributions to Plasma Physics, 56 (6-8), p. 569–574, 2016, ISSN: 1521-3986.

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Florian Carle; Sergey Semenov; Marc Medale; David Brutin

Contribution of convective transport to evaporation of sessile droplets: Empirical model Article de journal

Dans: International Journal of Thermal Sciences, 101 , p. 35 - 47, 2016, ISSN: 1290-0729.

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Omar Madani Fouatih; Marc Medale; Omar Imine; Bachir Imine

Design optimization of the aerodynamic passive flow control on NACA 4415 airfoil using vortex generators Article de journal

Dans: European Journal of Mechanics - B/Fluids, 56 , p. 82 - 96, 2016, ISSN: 0997-7546.

Résumé | Liens | BibTeX

Bessonov, O. A.

Effect of crystal and crubicle rotation on the flow stability in the Czochralski model at low Prandtl numbers Article de journal

Dans: Fluid Dynamics, 51 (4), p. 469–477, 2016, ISSN: 1573-8507.

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P Maget; O Février; H Lütjens; J-F Luciani; X Garbet

Bifurcation of magnetic island saturation controlled by plasma viscosity Article de journal

Dans: Plasma Physics and Controlled Fusion, 58 (5), p. 055003, 2016.

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Patrick Maget; Olivier Février; Xavier Garbet; Hinrich Lütjens; Jean-Francois Luciani; Alain Marx

Extended magneto-hydro-dynamic model for neoclassical tearing mode computations Article de journal

Dans: Nuclear Fusion, 56 (8), p. 086004, 2016.

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Jae-H Ahn; X Garbet; H Lütjens; R Guirlet

Dynamics of heavy impurities in non-linear MHD simulations of sawtoothing tokamak plasmas Article de journal

Dans: Plasma Physics and Controlled Fusion, 58 (12), p. 125009, 2016.

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J Denis; B Pégourié; J Bucalossi; H Bufferand; G Ciraolo; J-L Gardarein; J Gaspar; C Grisolia; E Hodille; M Missirlian; E Serre; P Tamain

Wall surface temperature calculation in the SolEdge2D-EIRENE transport code Article de journal

Dans: Physica Scripta, 2016 (T167), p. 014073, 2016.

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Athanassoula, E.

Boxy/Peanut/X Bulges, Barlenses and the Thick Part of Galactic Bars: What Are They and How Did They Form? Book Chapter

Dans: Laurikainen, Eija ; Peletier, Reynier ; Gadotti, Dimitri (Ed.): Galactic Bulges, p. 391–412, Springer International Publishing, Cham, 2016, ISBN: 978-3-319-19378-6.

Liens | BibTeX

Kim, Taehyun; Gadotti, Dimitri A.; Athanassoula, E.; Bosma, Albert; Sheth, Kartik; Lee, Myung Gyoon

Evidence of bar-induced secular evolution in the inner regions of stellar discs in galaxies: what shapes disc galaxies? Article de journal

Dans: Monthly Notices of the Royal Astronomical Society, 462 (4), p. 3430, 2016.

Liens | BibTeX

M. Ness; G. Zasowski; J. A. Johnson; E. Athanassoula; S. R. Majewski; A. E. García Pérez; J. Bird; D. Nidever; Donald P. Schneider; J. Sobeck; P. Frinchaboy; Kaike Pan; Dmitry Bizyaev; Daniel Oravetz; Audrey Simmons

APOGEE Kinematics. I. Overview of the Kinematics of the Galactic Bulge as Mapped By APOGEE Article de journal

Dans: The Astrophysical Journal, 819 (1), p. 2, 2016.

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Wang, Yougang; Athanassoula, E.; Mao, Shude

Orbital classification in an N-body bar Article de journal

Dans: Monthly Notices of the Royal Astronomical Society, 463 (4), p. 3499, 2016.

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E. Athanassoula; S. A. Rodionov; N. Peschken; J. C. Lambert

Forming Disk Galaxies in Wet Major Mergers. I. Three Fiducial Examples Article de journal

Dans: The Astrophysical Journal, 821 (2), p. 90, 2016.

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Huix-Rotllant Miquel; Ferré Nicolas

An Effective Procedure for Analyzing Molecular Vibrations in Terms of Local Fragment Modes Article de journal

Dans: Journal of Chemical Theory and Computation, 12 (10), p. 4768-4777, 2016, (PMID: 27642675).

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Stojanović Ljiljana; Bai Shuming; Nagesh Jayashree; Izmaylov Artur F.; Crespo-Otero Rachel; Lischka Hans; Barbatti Mario

New Insights into the State Trapping of UV-Excited Thymine Article de journal

Dans: Molecules, 21 (11, ARTICLE NUMBER = 1603), 2016, ISSN: 1420-3049.

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Ljiljana Stojanović; Abdulrahman O. Alyoubi; Saadullah G. Aziz; Rifaat H. Hilal; Mario Barbatti

UV excitations of halons Article de journal

Dans: The Journal of Chemical Physics, 145 (18), p. 184306, 2016.

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Achim Guckenberger; Marcel P. Schraml; Paul G. Chen; Marc Leonetti; Stephan Gekle

On the bending algorithms for soft objects in flows Article de journal

Dans: Computer Physics Communications, 207 , p. 1 - 23, 2016, ISSN: 0010-4655.

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Alexis Bottero; Paul Cristini; Dimitri Komatitsch; Mark Asch

An axisymmetric time-domain spectral-element method for full-wave simulations: Application to ocean acoustics Article de journal

Dans: The Journal of the Acoustical Society of America, 140 (5), p. 3520-3530, 2016.

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D Galassi; Patrick Tamain; Hugo Bufferand; G Ciraolo; Philippe Ghendrih; C Baudoin; C Colin; Nicolas Fedorczak; N Nace; E Serre

Drive of parallel flows by turbulence and large-scale E x B transverse transport in divertor geometry Dépubli

2016, (working paper or preprint).

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2015

Dominique Eckert, Mathilde Jauzac, HuanYuan Shan, Jean-Paul Kneib, Thomas Erben, Holger Israel, Eric Jullo, Matthias Klein, Richard Massey, Johan Richard & Céline Tchernin

Warm–hot baryons comprise 5–10 per cent of filaments in the cosmic web Article de journal

Dans: Nature, (528), p. 105–107, 2015.

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O. Bessonov

Highly Parallel Multigrid Solvers for Multicore and Manycore Processors. Article de journal

Dans: 2015.

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Ferraro, D.; Rech, J.; Jonckheere, T.; Martin, T.

Single quasiparticle and electron emitter in the fractional quantum Hall regime Article de journal

Dans: Phys. Rev. B, 91 , p. 205409, 2015.

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A. Pivano; Voicu O. Dolocan

3D versus 2D domain wall interaction in ideal and rough nanowires Article de journal

Dans: Journal of Magnetism and Magnetic Materials, 393 , p. 334 - 340, 2015, ISSN: 0304-8853.

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Bessonov, O. A.

Convective interactions and flow stability in the czochralskimodel in the case of crystal rotation Article de journal

Dans: Fluid Dynamics, 50 (3), p. 351–360, 2015, ISSN: 1573-8507.

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Jung, J.; Yi, X.; Huang, G.; Calvez, G.; Daiguebonne, C.; Guillou, O.; Cador, O.; Caneschi, A.; Roisnel, T.; Le Guennic, B.; Bernot, K.

Analysis of the electrostatics in DyIII single-molecule magnets: the case study of Dy(Murex)3 Article de journal

Dans: Dalton Trans., 44 , p. 18270-18275, 2015.

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Manas, P.; Camenen, Y.; Benkadda, S.; Hornsby, W. A.; Peeters, A. G.

Enhanced stabilisation of trapped electron modes by collisional energy scattering in tokamaks Article de journal

Dans: Physics of Plasmas, 22 (6), 2015.

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Poyé, A.; Agullo, O.; Muraglia, M.; Garbet, X.; Benkadda, S.; Sen, A.; Dubuit, N.

Generation of a magnetic island by edge turbulence in tokamak plasmas Article de journal

Dans: Physics of Plasmas, 22 (3), 2015.

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Thomas Engels; Dmitry Kolomenskiy; Kai Schneider; Jörn Sesterhenn

Numerical simulation of fluid–structure interaction with the volume penalization method Article de journal

Dans: Journal of Computational Physics, 281 , p. 96 - 115, 2015, ISSN: 0021-9991.

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Nicolas Foos; Corinne Maurel-Zaffran; María Jesús Maté; Renaud Vincentelli; Matthieu Hainaut; Hélène Berenger; Jacques Pradel; Andrew J. Saurin; Miguel Ortiz-Lombardía; Yacine Graba

A Flexible Extension of the Drosophila Ultrabithorax Homeodomain Defines a Novel Hox/PBC Interaction Mode Article de journal

Dans: Structure, 23 (2), p. 270 - 279, 2015, ISSN: 0969-2126.

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F. Golay; M. Ersoy; L. Yushchenko; D. Sous

Block-based adaptive mesh refinement scheme using numerical density of entropy production for three-dimensional two-fluid flows Article de journal

Dans: International Journal of Computational Fluid Dynamics, 29 (1), p. 67-81, 2015.

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Favier, B.; Grannan, A. M.; Le Bars, M.; Aurnou, J. M.

Generation and maintenance of bulk turbulence by libration-driven elliptical instability Article de journal

Dans: Physics of Fluids, 27 (6), 2015.

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de Loubens,C.; Deschamps,J.; Boedec,G.; Leonetti,M.

Stretching of capsules in an elongation flow, a route to constitutive law Article de journal

Dans: Journal of Fluid Mechanics, 767 , p. R3 (11 pages) doi = 10.1017/jfm.2015.69, 2015, ISSN: 1469-7645.

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Mollitor, Pol; Nezri, Emmanuel; Teyssier, Romain

Baryonic and dark matter distribution in cosmological simulations of spiral galaxies Article de journal

Dans: Monthly Notices of the Royal Astronomical Society, 447 (2), p. 1353-1369, 2015.

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Y. Marandet; H. Bufferand; J. Bucalossi; G. Ciraolo; S.W. Lisgo; E. Tsitrone

Assessment of tungsten sources in the edge plasma of WEST Article de journal

Dans: Journal of Nuclear Materials, 463 , p. 629 - 633, 2015, ISSN: 0022-3115, (PLASMA-SURFACE INTERACTIONS 21Proceedings of the 21st International Conference on Plasma-Surface Interactions in Controlled Fusion Devices Kanazawa, Japan May 26-30, 2014).

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H. Bufferand; J. Bucalossi; G. Ciraolo; N. Fedorczak; P. Genesio; Ph. Ghendrih; J. Gunn; Y. Marandet; C. Martin; N. Mellet; E. Serre; P. Tamain

Comparison on heat flux deposition between carbon and tungsten wall – Investigations on energy recycling Article de journal

Dans: Journal of Nuclear Materials, 463 , p. 420 - 423, 2015, ISSN: 0022-3115, (PLASMA-SURFACE INTERACTIONS 21Proceedings of the 21st International Conference on Plasma-Surface Interactions in Controlled Fusion Devices Kanazawa, Japan May 26-30, 2014).

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Colin, Clothilde; Tamain, Patrick; Schwander, Frederic; Serre, Eric; Bufferand, Hugo; Ciraolo, Guido; Fedorczak, Nicolas; Ghendrih, Philippe

Impact of the plasma-wall contact position on edge turbulent transport and poloidal asymmetries in 3D global turbulence simulations Article de journal

Dans: Journal of Nuclear Materials, 463 , p. 654-658, 2015.

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P Tamain; Ph Ghendrih; H Bufferand; G Ciraolo; C Colin; N Fedorczak; N Nace; F Schwander; E Serre

Multi-scale self-organisation of edge plasma turbulent transport in 3D global simulations Article de journal

Dans: Plasma Physics and Controlled Fusion, 57 (5), p. 054014, 2015.

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Juan Magaña; V. Motta; Vi´ctor H. Cárdenas; T. Verdugo; Eric Jullo