Solid Liquid Interfaces: Challenging Molecular Aspects for Industrial Applications [SLIMAIA]

IFP Energies nouvelles / Rueil-Malmaison (France) - From 27 to 29 March 2018

Poster session 

The posters are part of the program and were exhibited during the 3 days of the conference.


List of posters
  Click here if you wish to download the list of posters by topics.
P6 Calculation of a solid/liquid surface tension: a methodological study
  T. Dreher1,2, C. Lemarchand1, L. Soulard1, E. Bourasseau3, P. Malfreyt2, N. Pineau1 (1 CEA / DAM / DIF, 2 Univ. Clermont Auvergne, CNRS, ICCF, Sigma, 3 CEA / DEN / DEC, France)
P8 Interactions of divalent cations with hydrated clay particles edges
  B. F. Ngouana Wakou, L. Andronuik, A. G. Kalinichev (SUBATECH - Radiochimie, Institut Mines Telecom Atlantique, France)
P12 Surface wettability effect on molecular morphology, transport and reaction
  S. Zhao1, H. Liu2, Y. Hu2 (1 School of Chemical Engineering, East China Univ. of Science and Technology, 2 School of Chemistry and Molecular Engineering, East China Univ. of Science and Technology, China)
P15 Classical density functional theory of capacitors for blue energy applications
  S. W. Coles1, N. Ganfoud1, M. Salanne1,2, G. Jeanmairet1, B. Rotenberg1,3 (1 Sorbonne Univ., UPMC, CNRS, PHENIX ; 2 Maison de la Simulation, CEA, CNRS, INRIA, Univ. Paris-Sud, Univ. de Versailles ; 3 RS2E, France)
P18 Adsorption in flow conditions
  Z. Zaafouri1, B. Coasne2, G. Batot1, C. Nieto-Draghi1, D. Bauer1 (1 IFPEN ; 2 LiPhy, France)
P21 Materials with oriented hierarchical porosity as catalyst supports
  A. C. Bueno1,2, Y. Schuurman2, M. Klotz1, D. Farrusseng2 (1 Saint-Gobain CREE, Lab. de Synthèse et Fonctionnalisation des Céramiques, CNRS, 2 IRCELYON, Institut de recherches sur la catalyse et l'environnement, CNRS, France)
 P24 Study of the effect of temperature and time on the anticorrosive power of a schiff base molecule named {4, 4’ bis (2-furane carboxaldehyde) diimino diphenyl sulfide} on mild steel in acidic medium
  I. Benmahammed1, T. Douadi1, S. Issaadi2 (1 LEMMC, Dept. de Génie des Procédés, Faculté de Technologie, Univ. Ferhat Abbas Sétif-1 ; 3 Faculté des Sciences, dept. de Chimie, Univ. Ferhat Abbas Sétif-1, Algeria) 
 P25 Immobilized candida cylindracea lipase as a new and reusable catalyst for sugar ester synthesis
  C. Bidjou-Haiour, N. Rezgui, F. Loulou (Lomop, Groupe Synthèse Bio-Organique et Modélisation, Dept. of Chemistry, Faculty of Sciences, Algeria)
 P28 Removal of cupric ions from water by using cellulose nano fibers as adsorbent and copper carbonate microspheres formation by precipitation method
  S. Ladhari, A. Jada (IS2M, CNRS UHA, France)
 P29 Stabilization of magnetite aqueous dispersion by PS-PEO copolymer and its use as adsorbent for remediation of metal ions in polluted water
  I. Hachilif, A. Jada (IS2M, CNRS UHA, France)
 P30 The influence of nature and the content of silica on the synthesis of isostructural silicoaluminophosphate chabasite SAPO-34
  S. Bellatreche1,2, M. A. Hasnaoui2, A. Bengeddach2 (1 Faculty of Medicine, Univ. d’Oran ; 2 Lab. de chimie des matériaux, Univ. of Oran, Algeria)
 P31 Mesoscopic lattice-based simulation to account for electrokinetic and adsorption/desorption effects
  A. J. Asta1, M. Levesque2,3, B. Rotenberg1 (1 Sorbonne Univ., UPMC, CNRS, Lab. PHENIX ; 2 École Normale Supérieure, PSL Research Univ., UPMC, CNRS, Dept. de Chimie ; 3 Sorbonne Univ., UPMC, ENS, CNRS, France)
 P39 Elimination of acetylsalicylic acid by catalytic photodegradation
  L. Mahtout, S. Rabhi, H. Belkacemi, N. Benabdeslam (Univ. of Bejaia, Technology Lab. Materials, Faculty of Exact Sciences, Algeria)
 P42 Adsorptıve desulfurızatıon of gasolıne usıng Al2O3, SiO2, ZnO based adsorbents: a study on adsorbent composıton and reactıon condıtıons
  Y. Düşova-Teke, E. Yönel-Gümrük, S. Çelebi (1 Turkish Petroleum Refineries Corp., Turkey)
 P43 Ab initio molecular dynamics study of the γ-alumina / water interface
  B. F. Ngouana Wakou1, P. Cornette2, M. Corral Valero1, D. Costa2, P. Raybaud1 (1 IFPEN ; 2 Physico-Chimie des Surfaces, PSL Research Univ., CNRS, Institut de Recherche de Chimie Paris, Chimie ParisTech, France)
 P44 Improved oil recovery and CO2-storage by carbonated water injection
  I. Fjelde1,2,3, S. Erzuah1,2, A. Voke Omekeh1,3 (1 Univ. of Stavanger, 2 National IOR Centre of Norway, 3 IRIS, Norway)
 P47 Electrochemical treatment of wastewater containing cresol 
  Z. Taleb1, E. Morallón2, R. Berenguer3, C. Quijada4,  S. Taleb1 (1 Lab. of Materials & Catalysis, Faculty of Exact Sciences, Djillali Liabes Univ., Algeria ; 2 Instituto Univ. de Materiales, Dept. de Quımica Fısica, Univ. of Alicante, 3 Univ. of Málaga, Dept. de Ingeniería Química, 4 Dept. de Ingeniería Textil y Papelera, Univ. Politècnica de València, Spain)
 P51 Computational study of mea adsorption on hydroxylated CR2O3 surface 
  T. De Bruin1, A. Gouron1,2, A.C.T. Van Duin3, D. Van Duin3, B. Diawara2, F. Ropital4 (1 Dept. of Thermodynamics and Molecular Modeling, IFPEN, 2 Institut de Recherche de Chimie Paris, CNRS, Chimie ParisTech, France ; 3 RxFF Consulting, LLC, State College, USA ; 4 Dept. of Electrochemistry and Materials, IFPEN, France
 P53 The use of doped conducting polymers for supercapacitors 
  D. Amoura1, M. Sanchez-Jiménez2, F. Estrany2,3, L. Makhloufi1, C. Aleman3,4  (1 LECVE, Faculté de Technologie, Univ. of Bejaia, Algeria ; 2 Dept. d’Enginyeria Química, Escola Univ. d’Enginyeria Tècnica Industrial de Barcelona, Univ. Politècnica de Catalunya ; 3 Center for Research in Nano-Engineering, Univ. Politècnica de Catalunya, 4 Dept. d’Enginyeria Química, ETS d’Enginyers Industrials, Univ. Politècnica de Catalunya, Spain)
 P54 Chromium (III) and iron (III) removal onto chelex 100 resin in aquous medium: kinetic and thermodynamic study
  A. Amara-Rekkab, M. Amine Didi (Lab. of Separation and Purification Technologies, Faculty of Sciences, Dept. of Chemistry, Tlemcen Univ., Algeria)
 P58 Comparative study of the retention mechanisms of strontium and cesium on zeolites
  P. Gras, A. Geneste, B. Prelot, J. Zajac (ICGM, CNRS, Univ. Montpellier, France)
 P61 Removal of rhodamine 6G from aqueous solution by modified layered double hydroxides
  F. Gomri1,T. Chafia1, M. Boutahala1, A. Gil Bravo2 (1 Lab. de Génie des pPocédés Chimiques, Dept. de Génie des Procédés,  Faculté  de Technologie, Univ. Ferhat Abbas, Algeria ; 2 Dept. de Chimie Appliquée, Univ. Publique de Navarra, Spain) 
 P63 Removal of sodium dodecylbenzene sulfonate by uncalcined and calcined MGnial layered double hydroxides from aqueous solution
  C. Tiar, M. Boutahala (Lab. de Génie des Procédés Chimiques, Faculté de Technologie, Dept. Génie des procédés, Univ. Ferhat Abbas, Algeria)
 P64 Heterogeneous autocatalytic reactions: towards a macroscopic model of reactors for the dissolution of uranium dioxide 
  S. Lalleman1, F. Charlier1, A. Magnaldo1, P. Marc1, G. Borda1, É. Schaer2 (1 CEA, Nuclear Energy Division, Research Dept. of Mining and Fuel Recycling Processes ; 2 Lab. of Reaction and Process Engineering, CNRS, Univ. of Lorraine, France)
 P65 Adsorption studies of crystal violet dye from waste water onto activated bentonite composites
  A. Aichour, H. Zaghouane-Boudiaf (Lab. de Génie des Procédés chimiques, Dept. de Génie des Procédés, Faculté de Technologie, Univ. Ferhat Abbas, Algeria)
 P69 Study of photocatalytic degradation of a drug (ketoprofen)
  F. Naitali, H. Ghoualem (Lab. d’Électrochimie, Corrosion, Métallurgie et Chimie Minérale, Faculté de Chimie USTHB, Algeria) 
 P71 Study of synthetics dyes adsorption onto poly (vinyl alcohol) / glutaraldehyde / β-cyclodextrin polymer membranes 
  D. Ghemati, D. Aliouche (Lab. of Fibrous Polymers Treatment and Forming, FSI, M’Hamed Bougara Univ., Algeria) 
 P73 Kinetic study on iron oxides’ redox transformations under secondary conditions of nuclear power pressurized water reactor 
  Z. Li1,3, G. Lefevre1, C. Chaneac2, S. Delaunay3, A. Graff3 (1 PSL Research Univ., Chimie ParisTech, CNRS, Institut de Recherche de Chimie ; 2 Sorbonne Univ., UPMC, CNRS, Collège de France, LCMCP ; 3 EDF Research and Development, France)  
 P74 Developing an efficient approach for the computation of free solvation energy at the metal / liquid interface 
  P. Clabaut, B. Schweitzer, C. Michel, S. Steinmann (Univ. Lyon 1, École Normale Supérieure de Lyon, CNRS, Lab. de Chimie, France)
 P79 Electrochemical synthesis of a 1-cyano-tetrahydroisoquinoline 
  F. Louafi1, J-P. Hurvois2, L. Benmekhbi1, A. Chibani1 (1 Univ. of Constantine1, Dept. de Chimie, Algeria ; 2 Sciences chimiques de Rennes, CNRS, Univ. of Rennes 1,  France) 
 P81 Insight by operando tem on the thermal behaviour of cobalt-based fischer-tropsch catalysts
  K. Dembélé1,2, M. Bahri1,2, C. Hirlimann1, G. Melinte1, S. Moldovan, A. Berliet2, A.-S. Gay2, S. Maury2, O. Ersen1,3,4 (1 IPCMS, Univ. de Strasbourg, CNRS ; 2 IFPEN ; 3 USIAS, 4 IUF, France)
 P84 Modeling reactivity at the solid/liquid interface: are we there yet?
  C. Michel, S. Steinman (Lab. de Chimie, École Normale Supérieure de Lyon, France)
 P85 Determination of the surface charge of the water-solid surface at low and high pH
  S. Sun, M. Bonn, E. H.G. Backus (Max Planck Institute for Polymer Research, Germany)
 P88 Application of inverse liquid chromatography to the surface characteristics of mesoporous aluminosilicates
  K. Adamska, A. Voelkel (Institute of Chemical Technology and Engineering, Poznan Univ. of Technology, Poland) 
 P89 Binding free energies of amino acids in contact with fully hydrated TiO2 surfaces predicted by ab-initio calculations
  L. Agosta, E. G. Brandt, A. Lyubartsev (Stockholm univ. MMK, Sweden)
 P90 Adsorption of hydroxydes on graphene and H-BN single layers in water
  B. Grosjean, R. Vuilleumier, M-L. Bocquet (Dpt. de chimie, École normale supérieure, PSL Univ., Sorbonne Univ., CNRS, France)
 P91 The role of activation in the recovery of copper from chalcopyrite ore during the FLSmidth® ROL process
  A. P. Karcz1, A. Juul Damø1, K. Dam-Johansen1, D. Chaiko2 (1 Technical Univ. of Denmark, Denmark, 2 FLSmidth® Minerals, U.S.A)
 P92 Stabilisation and isomerisation of formic acid at a mineral/water interface
  S. Laporte, F. Pietrucci, F. Guyot, A. M. Saitta (IMPMC Sorbonne Univ., CNRS MNHN IRD, France)

Adsorption of water and glycine on rutile (110) surface, a DFT-D approach including implicit and explicit solvent

D. Costa1, J. J. Plata Ramos2,  A. Marquez2, J. Fdez Sanz2 (1 IRCP, CNRS, Chimie ParisTech, France ; 2 Univ. Sevilla, Spain)

 P94 First-principles molecular dynamics (FPMD) simulations of CO3O4/aqueous solutions interfaces: electrocatalysis & water splitting
  F. Creazzo, D. Galimberti, S. Pezzotti, M-P. Gaigeot (Lab. Analyse et Modélisation pour la Biologie et l'Environnement, Univ. d'Evry val d'Essonne, Univ. Paris-Saclay, France
 P95 Air/water and silica/water interfaces characterized by ab initio molecular dynamic
  S. Pezzotti1,2, D. R. Galimberti1,2, F. S. Brigiano1,2, M-P. Gaigeot1,2 (1 LAMBE, Univ. D’Evry Val d’Essonne, 2 Univ. Paris-Saclay, France)
 P96 Aqueous surface science: R-(1102) alpha-alumina in the presence of bulk liquid water
  L. Potier1,2, S. Pezzotti1,2, A. Cimas1,2, M-P. Gaigeot1,2 (1 LAMBE, Univ. d’Evry val d’Essonne, 2 Univ. Paris-Saclay, France)
 P97 Amorphous silica/water interfaces from DFT-MD simulations and VSFG spectroscopy
  F. S. Brigiano1,2, S. Pezzotti1,2, M-P. Gaigeot1,2 (1 LAMBE, Univ. d’Evry val d’Essonne, 2 Univ. Paris-Saclay, France)