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Publications

The ILL has firmly established itself as a pioneer in neutron science and technology. Neutron beams are used to carry out frontier research in diverse fields.

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Science at ILL

Publications

 

2017

  1. ``Effective Valence-Bond theory for strongly correlated systems.'', Marie Bernadette Lepetit et Alain Gellé, in press Computational and Theoretical Chemistry (2017) (invited paper).

  2. ``Combined first principle calculations and experimental study of the phonon modes in the multiferroic compound compound'', Elena Cannuccia, Vinh TaPhuoc, Benjamin Brière, Laurent Cario, Etienne Janod, Benoît Corraze et Marie Bernadette Lepetit, J. Phys. Chem C, 121, 3522 (2017).

  3. ``Recognition of exchange-striction as origin of magnetoelectric coupling in multiferroics.'', G. Yahia, F. Damay, S. Chattopadhyay, V. Balédent, W. Peng, E. Elkaim, M. Whitaker, M. Greenblatt, M.-B. Lepetit et P. Foury-Leylekian, in press Phys. Rev. B (2017).

  4. ``Theoretical Characteristics of Metalloporphyrins (OEP)M(CH3) (M=Al, Ga, In and Tl)'', M.-B. Lepetit, A. Zrineh et O.-K. Kabbaj, Der Pharma Chemica, 9, 80 (2017).

  5. ``Water sub-diffusion in membranes for fuel cells'', Q. Berrod S. Hanot, A. Guillermo and S. Mossa and S. Lyonnard, Scientific Reports 7, (2017).

  6. ``Finite Temperature Phases of Two Dimensional Spin-Orbit Coupled Bosons'', E. Kawasaki and M. Holzmann, Phys. Rev. A 95, 051601(R) (2017).

  7. ``Prizes of the French Academy of Sciences 2015, Foreword'', J. Villain, Comptes Rendus Physique 18, 1 (2017).

  8. ``Skew scattering from correlated systems: impurities and collective excitations in the Spin Hall Effect'', Timothy Ziman, Bo Gu, Sadamichi Maekawa, J. Phys. Soc. Jpn. 86, 011005 (2017).

  9. ``Spin waves in the fcc lattice antiferromagnet: competing interactions, frustration, and instabilities in the Hubbard model'', Avinash Singh, Shubhajyoti Mohapatra, Timothy Ziman, and Tapan Chatterji, J. of Appl. Phys. 121, 073903 (2017).

  10. ``Crowding-Controlled Cluster Size in Concentrated Aqueous Protein Solutions: Structure, Self- and Collective Diffusion'', Braun, Michal K. and Grimaldo, Marco and Roosen-Runge, Felix and Hoffmann, Ingo and Czakkel, Orsolya and Sztucki, Michael and Zhang, Fajun and Schreiber, Frank and Seydel, Tilo, J. Phys. Chem. Lett. 8, 2590 (2017).

  11. ``Strong Isotope Effects on Effective Interactions and Phase Behavior in Protein Solutions in the Presence of Multivalent Ions'', Braun, Michal K. and Wolf, Marcell and Matsarskaia, Olga and Da Vela, Stefano and Roosen-Runge, Felix and Sztucki, Michael and Roth, Roland and Zhang, Fajun and Schreiber, Frank, J. Phys. Chem. B 121, 1731 (2017).

  12. ``Effective Interactions and Colloidal Stability of Bovine γ-Globulin in Solution'', Da Vela, Stefano and Roosen-Runge, Felix and Skoda, Maximilian W. A. and Jacobs, Robert M. J. and Seydel, Tilo and Frielinghaus, Henrich and Sztucki, Michael and Schweins, Ralf and Zhang, Fajun and Schreiber, Frank, J. Phys. Chem. B, in press (2017).

  13. ``Effect of Phosphorylation on a Human-like Osteopontin Peptide'', Samuel Lenton and Marco Grimaldo and Felix Roosen-Runge and Frank Schreiber and Tommy Nylander and Roger Clegg and Carl Holt and Michael Härtlein and Victoria Garcia Sakai and Tilo Seydel and Susana C. Marujo Teixeira, Biophys. J. 112, 1586 (2017).

  14. ``Polymer brush collapse under shear flow'', A. Korolkovas, C. Rodriguez-Emmenegger, A. de los Santos Pereira, A. Chenneviere, F. Restagno, M. Wolff, F.A. Adlmann, A.J.C. Dennison, P. Gutfreund, Macromolecules 50, 1215 (2017).

  15. ``The Dynamical Transition of Lipid Multi-Lamellar Bilayers as a Matter of Cooperativity'', J. Peters, J. Marion, F. Natali, E. Kats and D. J. Bicout, J. Phys. Chem. B 121, 6860 (2017).

  16. ``Unitary dynamics of strongly-interacting Bose gases with time-dependent variational Monte Carlo in continuous space'', G. Carleo, L. Cevolani, L. Sanchez-Palencia, and M. Holzmann, Phys. Rev. X 7, 031026 (2017).

  17. ``Effective mass of quasiparticles from thermodynamics'', F.G. Eich, M. Holzmann, and G. Vignale, Phys. Rev. B 96, 035132 (2017).

  18. ``Control of the orbital ordering in manganite superlattices and impact on properties'', Aysegül Begüm Koçak, Julien Varignon, Sébastien Lemal Philippe Ghosez et Marie-Bernadette Lepetit, Phys. Rev. B 96, 125155 (2017).

  19. ``La décennie prodigieuse : 1895-1905'', Jean-Pierre Gaspard and Jacques Villain, two historical papers in Hérodote (2017).
  20. ``Correcting binding parameters for interacting ligand-lattice systems'', J. Hervy and D. J. Bicout, Phys. Rev. E, in press (2017).

  21. ``Slow quantum oscillations without Fermi Surface Reconstruction in Cuprate Superconductors'', P. Grigoriev and T. Ziman, JETP Letters 106 in press (2017).

  22. ``Magnetic oscillations measure interlayer coupling in cuprate superconductors, Phys. Rev. B, in press (2017).

 

 

 

2016

  1. ``What determines the sign of the spin Hall effects in Cu alloys doped with 5d elements?'', Zhuo Xu, Bo Gu, Michiyasu Mori, Timothy Ziman, and Sadamichi Maekawa, Journal of Magnetism and Magnetic Materials, 400, 184-187 (2016)

  2. ``Neutrons on a surface of liquid helium'', P.D. Grigoriev, O. Zimmer, A. D. Grigoriev, T. Ziman, Phys. Rev. C 94, 025504 (2016)

  3. ``Helicity, anisotropies, and their competition in a multiferroic magnet: Insight from the phase diagram'', Mariya V. Gvozdikova, Mike E. Zhitomirsky, Timothy Ziman, Phys. Rev. 94, 020406(R) (2016) ( Editor's Choice).

  4. ``How to compute the magneto-electric tensor from ab-initio calculations?'', Marie-Bernadette Lepetit, Theor. Chem. Acc 1 135 (2016).

  5. ``Spin-Orbital Nature of the High-Field Magnetic State in the Sr4Ru3O10 '', Veronica Granata, Lucia Capogna, Filomena Forte, Marie-Bernadette Lepetit, Rosalba Fittipaldi, Anne Stunault, Mario Cuoco et Antonio Vecchione, Phys. Rev. B 93, 115128 (2016).

  6. ``Relation of vibrational excitations and thermal conductivity to elastic heterogeneities in disordered solids'', Mizuno, Hideyuki and Mossa, Stefano and Barrat, Jean-Louis, Phys. Rev. B 94, 144303 (2016).

  7. ``Simulation of entangled polymer solutions '', Korolkovas, Airidas and Gutfreund, Philipp and Barrat, Jean-Louis, J. Chem. Phys. 145, 124113 (2016).

  8. ``Simulating confined particles with a flat density profile'', Korolkovas, Airidas, Phys. Rev. E 94, 021302 (2016).

  9. ``Cutoff nonlinearities in the low-temperature vibrations of glasses and crystals'', Mizuno, Hideyuki and Silbert, Leonardo E. and Sperl, Matthias and Mossa, Stefano and Barrat, Jean-Louis, Phys. Rev. E 93 , 043314 (2016).

  10. ``Sub-diffusion and population dynamics of water confined in soft environments'', Hanot, Samuel and Lyonnard, Sandrine and Mossa, Stefano, Nanoscale , (2016).

  11. ``Cation-Induced Hydration Effects Cause Lower Critical Solution Temperature Behavior in Protein Solutions'', Matsarskaia, Olga and Braun, Michal K. and Roosen-Runge, Felix and Wolf, Marcell and Zhang, Fajun and Roth, Roland and Schreiber, Frank, J. Phys. Chem. B 120, 7731 (2016).

  12. ``Analytical correlation functions for motion through diffusivity landscapes'', F. Roosen-Runge, D. J. Bicout and J.-L. Barrat, J. Chem. Phys. 144, 204109 (2016).

  13. ``Fermion sign problem in imaginary-time projection continuum quantum Monte Carlo with local interaction'', F. Calcavecchia and M. Holzmann, Phys. Rev. E 93 , 043321 (2016).

  14. ``Theory of Finite Size Effects for Electronic Quantum Monte Carlo Calculations of Liquids and Solids'', M. Holzmann, R.C. Clay III, M. A. Morales, N.M. Tubman, D. M. Ceperley, and C. Pierleoni, Phys. Rev. B 94, 035126 (2016).

  15. ``Quasi-Long-Range Order in Trapped 2D Bose Gases'', I. Boettcher and M. Holzmann, Phys. Rev. A 94, 011602(R) (2016).

  16. ``Condensed matter physics in the 21st century: The legacy of Jacques Friedel, foreword'',  Hélène Bouchiata and Jacques Villain, Comptes Rendus Physique 17, 233 (2016).

  17. ``Jacques Friedel and the physics of metals and alloys'', Jacques Villain, Mireille Lavagna and Patrick Bruno, Comptes Rendus Physique 17, 276 (2016).

  18. ``Structure of covalently bonded materials: From the Peierls distortion to Phase-Change Materials'', Jean-Pierre Gaspard, Comptes Rendus Physique 17, 389 (2016).

 

 

2015

  1. ``Enhanced spin Hall effect by electrons correlations in CuBi alloys'', Bo Gu, Zhuo Xu, Michiyasu Mori, Timothy Ziman, and Sadamichi Maekawa J. Appl. Phys. J. Appl. Phys. 117, 17D503 (2015).

  2. ``Analysis of the spin Hall effect in CuIr alloys: Combined approach of density functional theory and Hartree-Fock approximation'', Zhuo Xu, Bo Gu, Michiyasu Mori, Timothy Ziman, and Sadamichi Maekawa, J. Appl. Phys. 117, 17D510 (2015)

  3. ``Sign change of the Spin Hall Effect due to Electron Correlation in Nonmagnetic CuIr alloys'', Z. Xu, B. Gu, M. Mori, T. Ziman, S. Maekawa Phys. Rev. Lett. 114, 017202 (2015)

  4. ``Strong Suppression of the Spin Hall Effect in the Spin Glass State'', Y. Niimi, M. Kimata, Y. Omori, B. Gu, T. Ziman, S. Maekawa, A. Fert, and Y. Otani Physical Review Letters, Phys. Rev. Lett. 115, 196602 (2015)

  5. ``Beating the amorphous limit in thermal conductivity by superlattices design'', Mizuno, Hideyuki and Mossa, Stefano and Barrat, Jean-Louis, Sci. rep. 5, 14116 (2015).

  6. ``Correlation of structure and mechanical response in solid-like polymers'', S. Jabbari-Farouji, J. Rottler, O. Lame, A. Makke, M. Perez, J.-L. Barrat, J. Phys.: Condens. Matter 27, 194131 (2015)

  7. ``Plastic deformation mechanisms of semicrystalline and amorphous polymers'', Jabbari-Farouji S., Rottler J., Lame O., Makke A., Perez M., Barrat J.L., Macro Letters 4, 147 (2015)

  8. ``Elastic consequences of a single plastic event: Towards a realistic account of structural disorder and shear wave propagation in models of flowing amorphous solids'', Nicolas A., Puosi F., Mizuno H., Barrat J.L., J. Mech. Phys. Solids 78, 333 (2015)

  9. ``Water confined in self-assembled ionic surfactant nano-structures'', Hanot, Samuel and Lyonnard, Sandrine and Mossa, Stefano, Soft Matter 11, 2469 (2015).

  10. ``Hierarchical molecular dynamics of bovine serum albumin in concentrated aqueous solution below and above thermal denaturation'', Grimaldo, Marco and Roosen-Runge, Felix and Hennig, Marcus and Zanini, Fabio and Zhang, Fajun and Jalarvo, Niina and Zamponi, Michaela and Schreiber, Frank and Seydel, Tilo, Phys. Chem. Chem. Phys. 17, 4645 (2015).

  11. ``On the question of two-step nucleation in protein crystallization'', Sauter, Andrea and Roosen-Runge, Felix and Zhang, Fajun and Lotze, Gudrun and Feoktystov, Artem and Jacobs, Robert M. J. and Schreiber, Frank, Faraday Discuss. 179, 41 (2015).

  12. ``Real-Time Observation of Nonclassical Protein Crystallization Kinetics'', Sauter, Andrea and Roosen-Runge, Felix and Zhang, Fajun and Lotze, Gudrun and Jacobs, Robert M. J. and Schreiber, Frank, J. Am. Chem. Soc. 137, 1485 (2015).

  13. ``Anomalous and anisotropic nanoscale diffusion of hydration water molecules in fluid lipid membranes'', Toppozini, Laura and Roosen-Runge, Felix and I. Bewley, Robert and M. Dalgliesh, Robert and Perring, Toby and Seydel, Tilo and Glyde, Henry R. and Garcia Sakai, Victoria and Rheinstadter, Maikel C., Soft Matter 11, 8354 (2015).

  14. ``Salt-Induced Universal Slowing Down of the Short-Time Self-Diffusion of a Globular Protein in Aqueous Solution'', Grimaldo, Marco and Roosen-Runge, Felix and Hennig, Marcus and Zanini, Fabio and Zhang, Fajun and Zamponi, Michaela and Jalarvo, Niina and Schreiber, Frank and Seydel, Tilo, J. Phys. Chem. Lett. 6, 2577 (2015).

  15. ``Iterative backflow renormalization procedure for many-body ground state wave functions of strongly interacting normal Fermi liquids'', M. Taddei, M. Ruggeri, S. Moroni and M. Holzmann, Phys. Rev. B 91, 115106 (2015).

  16. ``Prizes of the French Academy of Sciences 2014, Foreword'', J. Villain, Comptes Rendus Physique 16, 705 (2015).

  17. ``Evidence for room temperature electric polarization in RMn2O5 multiferroics'', V. Balédent, S. Chattopadhyay, P. Fertey, M.-B. Lepetit, M. Greenblatt, B. Wanklyn, F. O. Saouma, J. I. Jang et P. Foury-Leylekian, Phys. Rev. Letters 114, 117601 (2015).

  18. ``Phonons in the multiferroic compound Ba3NbFe3Si2O14 : evidences for symmetry breaking?.'', C. Toulouse, M. Cazayous, F. Levy-Bertrand, H. Barkaoui, V. Simonet, R. Ballou, P. Lejay, S. de Brion, L. Chai, M.B. Lepetit, J. B. Brubach and P. Roy, Phys. Rev. B 92, 104302 (2015).

  19. ``Exploring approximations to the GW self-energy ionic gradients.'', Faber C., Boulanger P., Attaccalite C., Cannuccia E., Duchemin I., Deutsch T., Blase X., Phys. Rev. B 91, 155109 (2015).

  20. ``High-resolution neutron spectroscopy on protein solution samples'', Grimaldo, Marco and Roosen-Runge, Felix and Jalarvo, Niina and Zamponi, Michaela and Zanini, Fabio and Hennig, Marcus and Zhang, Fajun and Schreiber, Frank and Seydel, Tilo, EPJ Web of Conferences 83, 02005 (2015).

  21. ``A generalized mean-squared displacement from inelastic fixed window scans of incoherent neutron scattering as a model-free indicator of anomalous diffusion confinement'', Roosen-Runge, Felix and Seydel, Tilo, EPJ Web of Conferences 83, 02015(2015).

  22. ``Diffusion in membranes: Toward a two-dimensional diffusion map'', EPJ Web of Conferences 83, 2019 (2015).

  23. ``Crystallization under Supervision: Following Protein Crystallization in Real-Time'', Sauter, Andrea and Roosen-Runge, Felix and Zhang, Fajun and Lotze, Gudrun and Jacobs, Robert M. J. and Schreiber, Frank, GIT Laboratory Journal 7, 26 (2015).

 

2014

  1. ``Acoustic excitations and elastic heterogeneities in disordered solids'', Mizuno, Hideyuki and Mossa, Stefano and Barrat, Jean-Louis, PNAS 111, 11949 (2014).

  2. ``Rheology of athermal amorphous solids: Revisiting simplified scenarios and the concept of mechanical noise temperature'', Nicolas A., Martens K., Barrat J.L., EPL 107, 44003 (2014).

  3. ``Universal and non-universal features in coarse-grained models of flow in disordered solids'', Nicolas A., Martens K., Bocquet L., Barrat J.L., Soft Matter 10, 4648 (2014)

  4. ``Spatiotemporal correlations between plastic events in the shear flow of athermal amorphous solids'', Nicolas A., Rottler J., Barrat J.L., Eur. Phys. J E 37, 50 (2014)

  5. ``Time-dependent elastic response to a local shear transformation in amorphous solids'', Puosi F., Rottler J., Barrat J.L., Phys. Rev. E 89, 042302 (2014)

  6. ``Molecular dynamics simulation of electrokinetic flow of an aqueous electrolyte solution in nanochannels'', Yoshida H., Mizuno H., Kinjo T., Washizu H., Barrat J.L., J. Chem. Phys. 140, 214701 (2014)

  7. ``Diffusion and Dynamics of gamma-Globulin in Crowded Aqueous Solutions'', Grimaldo, Marco and Roosen-Runge, Felix and Zhang, Fajun and Seydel, Tilo and Schreiber, Frank, J. Phys. Chem. B 118, 7203 (2014).

  8. ``Competing Salt Effects on Phase Behavior of Protein Solutions: Tailoring of Protein Interaction by the Binding of Multivalent Ions and Charge Screening'', Jordan, Elena and Roosen-Runge, Felix and Leibfarth, Sara and Zhang, Fajun and Sztucki, Michael and Hildebrandt, Andreas and Kohlbacher, Oliver and Schreiber, Frank, J. Phys. Chem. B 118, 11365 (2014).

  9. ``Ion-activated Attractive Patches as a Mechanism for Controlled Protein Interactions'', Felix Roosen-Runge, Fajun Zhang, Frank Schreiber and Roland Roth, Sci. Rep. 4, 7016 (2014).

  10. ``Protein Cluster Formation in Aqueous Solution in the Presence of Multivalent Metal Ions - a Light Scattering Study'', Soraruf, Daniel and Roosen-Runge, Felix and Grimaldo, Marco and Zanini, Fabio and Schweins, Ralf and Seydel, Tilo and Zhang, Fajun and Roth, Roland and Oettel, Martin and Schreiber, Frank, Soft Matter 10, 894 (2014).

  11. ``Effective interactions in protein–salt solutions approaching liquid–liquid phase separation '', Marcell Wolf and Felix Roosen-Runge and Fajun Zhang and Roland Roth and Maximilian W.A. Skoda and Robert M.J. Jacobs and Michael Sztucki and Frank Schreiber, J. Mol. Liq. A 200, 20 (2014).

  12. ''Approches pour le traitement des solides et des surfaces'', A. Markovits et M.-B. Lepetit, L'actualité chimique 382-383, 29 (2014) (invited paper).

  13. ``Orbital ordering driven multiferroicity and magnetoelectric coupling in '', K. Singh, Ch. Simon, E. Cannuccia, M.-B. Lepetit, B. Corraze, E. Janod et L. Cario, Phys. Rev. Letters 113, 137602 (2014).

  14. ``Electron-electron and electron-phonon correlation effects on the finite-temperature electronic and optical properties of zinc-blende GaN'', Kawai H., Yamashita K., Cannuccia E., Marini A., Phys. Rev. B 89, 085202 (2014)

  15. ``Verification of first-principles codes: Comparison of total energies, phonon frequencies, electron-phonon coupling and zero-point motion correction to the gap between ABINIT and QE/Yambo'', Ponce S., Antonius G., Boulanger P., Cannuccia E., Marini A., Côté M., Gonze X., Comp. Mat. Science 83, 341 (2014)