Publications Scientifiques

Depuis 2012

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Les publications sont listées “en vrac”. Retrouvez ci-dessous celles pour l'année en cours :


  • Georges Menzildjian, Alicia Lund, Maxim Yulikov, David Gajan, Lorenzo Niccoli, Ganesan Karthikeyan, Gilles Casano, Gunnar Jeschke, Olivier Ouari, Moreno Lelli, and Anne Lesage, Efficient Dynamic Nuclear Polarization up to 230 K with Hybrid BDPA-Nitroxide Radicals at a High Magnetic Field, Phys. Chem. B 125, 48, 13329–13338,, (2021)
  • Paul Clabaut, Benjamin Schweitzer, Andreas W. Götz, Carine Michel, and Stephan N. Steinmann, Solvation Free Energies and Adsorption Energies at the Metal/Water Interface from Hybrid Quantum-Mechanical/Molecular Mechanics Simulations, J. Chem. Theory Comput. 2020, 16, 10, 6539–6549,, (2021)
  • Christian O. Blanco, Joshua Sims, Daniel L. Nascimento, Alexandre Y. Goudreault, Stephan N. Steinmann, Carine Michel, Deryn E. Fogg, The Impact of Water on Ru-Catalyzed Olefin Metathesis: Potent Deactivating Effects Even at Low Water Concentrations, ACS Catal. 2021, 11, 2, 893–899,, (2021)
  • Sigismund T. A. G. Melissen, Tangui Le Bahers, Philippe Sautet, Stephan N. Steinmann, What does graphitic carbon nitride really look like? Physical Chemistry Chemical Physics,, (2021)
  • Sarah Blanck, Carles Martí, Sophie Loehlé, Stephan N. Steinmann, Carine Michel, (Dis)Similarities of adsorption of diverse functional groups over alumina and hematite depending on the surface state, The Journal of Chemical Physics, Volume 154, Issue 8 , 10.1063/5.0038412,, (2021)
  • Kamila Kaźmierczak, Paul Clabaut, Ruben Staub, Noémie Perret, Stephan N. Steinmann, and Carine Michel, Designing Active Sites for Structure-Sensitive Reactions via the Generalized Coordination Number: Application to Alcohol Dehydrogenation, J. Phys. Chem. C 125, 19, 10370–10377,, (2021)
  • Ruben Staub, Stephan N.Steinmann, Efficient recursive least squares solver for rank-deficient matrices, Applied Mathematics and Computation, Volume 399, 125996,, (2021)
  • Carles Martí, Sarah Blanck, Ruben Staub, Sophie Loehlé, Carine Michel, and Stephan N. Steinmann, DockOnSurf: A Python Code for the High-Throughput Screening of Flexible Molecules Adsorbed on Surfaces, J. Chem. Inf. Model. 2021, 61, 7, 3386–3396,, (2021)
  • Nawras Abidi, Audrey Bonduelle-Skrzypczak, and Stephan N. Steinmann, How Stable Are 2H-MoS2 Edges under Hydrogen Evolution Reaction Conditions?,The Journal of Physical Chemistry C,, (2021)
  • S. Boury, I. Sibgatullin, E. Ermanyuk, N. Shmakova, P. Odier, S. Joubaud, L.R.M. Maas, and T. Dauxois , Vortex cluster arising from an axisymmetric inertial wave attractor, Journal of Fluid Mechanics (2021)
  • R. Everaers, N. B. Becker, A. Rosa , Single-molecule stretching experiments of flexible (wormlike) chain molecules in different ensembles: Theory and a potential application of finite chain length effects to nick-counting in DNA, Journal of Chemical Physics 154, 024903, (2021),
  • Vericel A., Gonzalez J.-F., Price D.J., Laibe G., Pinte C. , Monthly Notices of the Royal Astronomical Society, Volume 507, Issue 2 (2021), pp.2318-2338
  • Ralf Aurich, Thomas Buchert, Martin J. France and Frank Steiner , The variance of the CMB temperature gradient: a new signature of a multiply connected Universe, Astrophysics, Cosmology and Nongalactic Astrophysics (2021)
  • K. Goloviznina, Z. Gong, M. Costa Gomes, A.A.H. Padua , Extension of the CL&Pol Polarizable Force Field to Electrolytes, Protic Ionic Liquids and Deep Eutectic Solvents, J. Chem. Theory Comput. 17 (2021) 1606–1617, DOI:10.1021/acs.jctc.0c01002
  • J.S. Freeman, K. Goloviznina, H. Li, M. Saunders, G.G. Warr, A.A.H. Pádua, R. Atkin , Ambient Energy Dispersion and Long Term Stabilisation of Large Graphene Sheets from Graphite Using a Surface Energy Matched Ionic Liquid, J. Ion. Liq. 1 (2021) 100001, DOI: 10.1016/j.jil.2021.100001
  • Antoine Mérien, Julie Tahraoui-Bories, Michel Cailleret, Jean-Baptiste Dupont, Céline Leteur, Jérôme Polentes, Alexandre Carteron, Hélène Polvèche, Jean-Paul Concordet, Christian Pinset, Margot Jarrige, Denis Furling, Cécile Martinat , CRISPR gene editing in pluripotent stem cells reveals the function of MBNL proteins during human in vitro myogenesis, Human Molecular Genetics, 25 juil. 2021, doi : 10.1093/hmg/ddab218
  • Margot Jarrige, Hélène Polvèche, Alexandre Carteron, Stéphane Janczarski, Marc Peschanski, Didier Auboeuf, Cécile Martinat , SISTEMA: A large and standardized collection of transcriptome data sets for human pluripotent stem cell research, iScience, 23 juin 2021, doi : 10.1016/j.isci.2021.102767
  • Anchel González-Barriga, Louison Lallemant, Diana M. Dincã, Sandra O. Braz, Hélène Polvèche, Paul Magneron, Cédric Pionneau, Aline Huguet-Lachon, Jean-Baptiste Claude, Cerina Chhuon, Ida Chiara Guerrera, Cyril F. Bourgeois, Didier Auboeuf, Geneviève Gourdon and Mário Gomes-Pereira , Integrative Cell Type-Specific Multi-Omics Approaches Reveal Impaired Programs of Glial Cell Differentiation in Mouse Culture Models of DM1, Frontiers in Cellular Neuroscience, 5 mai 2021, doi: 10.3389/fncel.2021.662035
  • Mournetas V., Massouridès E., Dupont J._B., Kornobis E., Polvèche H., Jarrige M., Dorval A., Gosselin M., Manousopoulou A., Garbis S., Górecki D., Pinset C. , Myogenesis modelled by human pluripotent stem cells: a multi‐omic study of Duchenne myopathy early onset, Journal of Cachexia, Sarcopenia and Muscle, févr 2021,


  • F.Besnard, J.Picao-Osorio, C.Dubois, and M.-A. Félix , A broad mutational target explains a fast rate of phenotypic evolution, C. R. Landry, Ed., eLife 9: e54928.,, (2020)
  • F. Ragone and F. Bouchet , Computation of extremes values of time averaged observables in climate models with large deviation techniques, J. Stat. Phys., pp 1–29, arXiv:1907.05762, (2020),
  • E. Woillez and F. Bouchet , Transport in Hamiltonian systems with slowly changing phase space structure, Nonlinear Science and Numerical Simulation 80, 104935, DOI, arXiv:1902.06309, (2020)
  • C. Herbert, R. Caballero and F. Bouchet , Atmospheric bistability and abrupt transitions to superrotation: wave-jet resonance and Hadley cell feedbacks, Journal of the Atmospheric Sciences vol. 77, no. 1, DOI, arXiv:1905.12401,(2020)
  • F. Bouchet, E. Woillez , Instantons for the destabilization of the inner Solar System, Phys. Rev. Lett., 125, 021101, DOI, arXiv:1910.04005, This paper has been the subject of a highlight by Nature Review Physics., (2020),
  • T. Lestang, F. Bouchet, and E. Lévêque , Rare-event sampling applied to the simulation of extreme mechanical efforts exerted by a turbulent flow on a bluf body, Journal of Fluid Mechanics, (2020) 895, A19. , DOI, arXiv:2002.10398
  • Cecilia Agamah, Sami Vuori, Pauline Colinet, Isabella Norrbo, José Miranda de Carvalho, Liana Key Okada Nakamura, Joachim Lindblom, Ludo van Goethem, Axel Emmermann, Timo Saarinen, Tero Laihinen, Eero Laakkonen, Johan Lindén, Jari Konu, Henk Vrielinck, David Van der Heggen, Philippe F Smet, Tangui Le Bahers, Mika Lastusaari , Hackmanite–the natural glow-in-the-dark material, Chemistry of Materials, (2020)
  • Pauline Colinet, Aria Gheeraert, Antton Curutchet, Tangui Le Bahers , On the Spectroscopic Modeling of Localized Defects in Sodalites by TD-DFT, The Journal of Physical Chemistry C, 124, 8949-8957 (2020)
  • P Husseini, D Varma, T Dauxois, S Joubaud, P Odier, M Mathur, Experimental study on superharmonic wave generation by resonant interaction between internal wave modes, Physical Review Fluids, 5, 074804 (2020) DOI: 10.1103/PhysRevFluids.5.074804
  • G Davis, T Jamin, J Deleuze, S Joubaud, T Dauxois, Succession of Resonances to Achieve Internal Wave Turbulence, Physical Review Letters, 124, 204502 (2020) DOI: 10.1103/PhysRevLett.124.204502
  • C Madec, B Collin, J John Soundar Jerome, S Joubaud, Puzzling Bubble Rise Speed Increase in Dense Granular Suspensions, Physical Review Letters, 125, 078004 (2020)
  • S Boury, P Odier, T Peacock, Axisymmetric internal wave transmission and resonant interference in nonlinear stratifications, Journal of Fluid Mechanics, 886, A8-1 (2020)
  • A Kobsch, R Caracas, The critical point and the supercritical state of alkali feldspars: implications for the behavior of the crust during impacts. Journal of Geophysical Research: Planets, Planets 125 (2020)
  • C Herrero, G Tocci, S Merabia, L Joly , Fast increase of nanofluidic slip in supercooled water: the key role of dynamics, Nanoscale, Issue 39, 2020,
  • G Triqueneaux, C Burny, O Symmons, St Janczarski, H Gruffat, G Yvert, Cell-to-cell expression dispersion of B-cell surface proteins is linked to genetic variants in humans, Communications Biology volume 3, Article number: 346 (2020),
  • K. Bernardino, K. Goloviznina, M. Costa Gomes, A. A. H. Pádua, M. C. C. Ribeiro., Ion pair free energy surface as a probe of ionic liquid structure, J. Chem. Phys. 152, 014103 (2020), DOI: 10.1063/1.5128693.
  • C Panaritis, YM Hajar, L Treps, C Michel, EA Baranova, SN Steinmann, SN , Demystifying the Atomistic Origin of the Electric Field Effect on Methane Oxidation JOURNAL OF PHYSICAL CHEMISTRY LETTERS Volume: 11 Issue: 17 Pages: 6976-6981 DOI: 10.1021/acs.jpclett.0c01485 Published: SEP 3 2020
  • P Clabaut, R Staub, J Galiana, E Antonetti, SN Steinmann , Water adlayers on noble metal surfaces: Insights from energy decomposition analysis, JOURNAL OF CHEMICAL PHYSICS Volume: 153 Issue: 5 Article Number: 054703 DOI: 10.1063/5.0013040 Published: AUG 7 2020
  • C Panaritis, C Michel, M Couillard, EA Baranova, SN Steinmann, Check Elucidating the role of electrochemical polarization on the selectivity of the CO 2 hydrogenation reaction over Ru, ELECTROCHIMICA ACTA Volume: 350 Article Number: 136405 DOI: 10.1016/j.electacta.2020.136405 Published: AUG 1 2020
  • N Abidi, A Bonduelle-Skrzypczak, SN Steinmann, Revisiting the Active Sites at the MoS2/H2O Interface via Grand-Canonical DFT: The Role of Water Dissociation, ACS APPLIED MATERIALS & INTERFACES Volume: 12 Issue: 28 Pages: 31401-31410 DOI: 10.1021/acsami.0c06489 Published: JUL 15 2020
  • A Curutchet, P Colinet, C Michel, SN Steinmann, T Le Bahers, Two-sites are better than one: revisiting the OER mechanism on CoOOH by DFT with electrode polarization, PHYSICAL CHEMISTRY CHEMICAL PHYSICS Volume: 22 Issue: 13 Pages: 7031-7038 DOI: 10.1039/d0cp00281j Published: APR 7 2020
  • AY Goudreault, DM Walden, DL Nascimento, AG Botti, SN Steinmann, C Michel, DE Fogg, Hydroxide-Induced Degradation of Olefin Metathesis Catalysts: A Challenge for Metathesis in Alkaline Media ACS CATALYSIS Volume: 10 Issue: 6 Pages: 3838-3843 DOI: 10.1021/acscatal.9b05163 (2020)
  • R. Staub, SN. Steinmann , Parameter-free coordination numbers for solutions and interfaces, JOURNAL OF CHEMICAL PHYSICS Volume: 152 Issue: 2 Article Number: 024124 DOI: 10.1063/1.5135696 (2020)
  • A. Massaro, J. Ávila, K. Goloviznina I. Rivalta, C. Gerbaldi, M. Pavone, M.F. Costa Gomes, A.A.H. Padua, Sodium diffusion in ionic liquid-based electrolytes for Na-ion batteries: the effect of polarizable force fields, PCCP 22 (2020) 20114-20122, DOI: 10.1039/D0CP02760J
  • K. Bernardino, K. Goloviznina, A.A.H. Padua, M.C.C. Ribeiro, Ion Pair Free Energy Surface as a Probe of Ionic Liquid Structure, J. Chem. Phys. (2020) DOI: 10.1063/1.5128693
  • Just J and Bendahmane M., Rosa spp., Trends in Genetics : Genome of the month (2020), DOI: 10.1016/j.tig.2019.11.002
  • Galvan-Ampudia CS, Cerutti G, Legrand J, Brunoud G, Martin-Arevalillo R, Azais R, Bayle V, Moussu S, Wenzl C, Jaillais Y, Lohmann JU, Godin C, Vernoux T., Temporal integration of auxin information for the regulation of patterning, eLIFE (2020), DOI: 10.7554/eLife.55832
  • Doll NM, Just J, Brunaud V, Caïus J, Grimault A, Depège-Fargeix N,Esteban E, Pasha A, Provart NJ, Ingram GC, Rogowsky PM, Widiez T. , Transcriptomics at Maize Embryo/Endosperm Interfaces Identifies a Transcriptionally Distinct Endosperm Subdomain Adjacent to the Embryo Scutellum, The Plant Cell, Vol. 32: 833–852 (2020) DOI: 10.1105/tpc.19.00756
  • Lamya Ben Ameur, Paul Marie, Morgan Thenoz, Guillaume Giraud, Emmanuel Combe, Jean-Baptiste Claude, Sebastien Lemaire, Nicolas Fontrodona, Hélène Polveche, Marine Bastien, Antoine Gessain, Eric Wattel, Cyril F Bourgeois, Didier Auboeuf , Franck Mortreux , Intragenic Recruitment of NF-κB Drives Splicing Modifications Upon Activation by the Oncogene Tax of HTLV-1, Nature Comm., (2020) DOI:10.1038/s41467-020-16853-x
  • Barnes Loic, Allouche Abdul-Rahman, Chambert Stéphane, Schindler Baptiste, Compagnon Isabelle , Ion spectroscopy of heterogeneous mixtures: IRMPD and DFT analysis of anomers and conformers of monosaccharides, International Journal of Mass Spectrometry, 2020
  • R. Schira, F. Rabilloud , Oxidation-Induced Surface Plasmon Band Fragmentation in Silver Clusters, J. Phys. Chem. C 124, 968-975 (2020).

Liste des journaux

1 ACS Journal of Physical Chemistry C
1 International Journal of Mass Spectrometry
1 Journal of Chemical Physics
1 Nature Comm
1 The Plant Cell
1 Trends in Genetics : Genome of the month

La liste des journaux sera mise à jour fin 2020 lorsque toutes les informations nous aurons été transmises.

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Sources et explications pour données SJR (Scientific Journal Rankings) et H index

Sources pour données Impact Factor

science/publications/accueil.txt · Dernière modification: 2022/03/17 11:33 par ccalugar