2011

Articles

Acs Catalysis 2011, 1 (10), 1430-1440.
Michel, Carine; Auneau, Florian; Delbecq, Francoise; Sautet, Philippe
"C-H Versus O-H Bond Dissociation for Alcohols on a Rh(111) Surface: A Strong Assistance from Hydrogen Bonded Neighbors"
Abstract; full text via subscription

Advanced Synthesis & Catalysis 2011, 353(11-12), 2067-2077.
P. Dimitrov Raytchev, A. Bendjeriou, A. Martinez, J.-P. Dutasta
"A New Step Towards Solid Base Catalysis: Azidoproazaphosphatranes Immobilized in Nanopores of Mesoporous Silica"

Angewandte Chemie-International Edition 2011, 50 (7), 1584-1588.
E. de Smit, M. M. van Schooneveld, F. Cinquini, H. Bluhm, P. Sautet, F. M. F. de Groot, B. M. Weckhuysen
"On the Surface Chemistry of Iron Oxides in Reactive Gas Atmospheres"
Abstract; full text via subscription

Angewandte Chemie-International Edition 2011 in press
O. Perraud, V. Robert, H. Gornitzka, A. Martinez, J.-P. Dutasta 
Gathering Cation-π and Anion-π Interactions for Zwitterions Recognition

Angewandte Chemie-International Edition 2011, 50 (14), 3202-3205.
R. Wischert, C. Coperet, F. Delbecq, P. Sautet
"Optimal Water Coverage on Alumina: A Key to Generate Lewis Acid-Base Pairs That Are Reactive Towards the C-H Bond Activation of Methane"
Abstract; full text via subscription

Biochimie 2011, 93(1), 101-112.
Queneau, Yves; Dumoulin, Fabienne; Cheaib, Rouba; Chambert, Stephane; Andraud, Chantal; Bretonniere, Yann; Blum, Loic J.; Boullanger, Paul; Girard-Egrot, Agnes
"Two-dimensional supramolecular assemblies involving neoglycoplipids: Self-organization and insertion properties into Langmuir monolayers"

Biomolecular Chemistry 2011, 9(14), 5086-5091.
J. Vachon, S. Harthong, E. Jeanneau, C. Aronica, N. Vanthuyne, C. Roussel, J.-P. Dutasta
Inherently chiral phosphonatocavitands as artificial chemo- and enantio-selective receptors of natural ammoniums

Bioorganic and medicinal chemistry 2011, 19(13), 4135-43.
Boutin Celine; Stopin Antoine; Lenda Fatimazohra; Brotin Thierry; Dutasta Jean-Pierre; Jamin Nadege; Sanson Alain; Boulard Yves; Leteurtre Francois; Huber Gaspard
"Cell uptake of a biosensor detected by hyperpolarized 129Xe NMR: the transferrin case"

Bulletin Du Cancer 2011, 98, S71-S72.
J. Hasserodt, O. Thorn-Seshold
"Fluorogenic Substrate for Peptidases" (French patent FR1158732, 2011)"

BUP (2011), 105(939), 1259-1277.
Raytchev, Pascal Dimitrov; Faure, Anne-Charlotte; Massin, Julien; Payet, Elina; Touti, Faycal; Albela, Belen; Le Marechal, Jean-Francois; Monnereau, Cyrille
"An investigative approach at the university level: raising the question to the student".

BUP 2011, 105(931), 175-185.
Perraud, Olivier; Martinez, Alexandre
" "Experimental methods for measuring enantiomeric excess".

Chemcatchem 2011, 3 (1), 200-207.
C. Mager-Maury, G. Bonnard, C. Chizallet, P. Sautet, P. Raybaud
"H-2-Induced Reconstruction of Supported Pt Clusters: Metal-Support Interaction Versus Surface Hydride".
Abstract; full text via subscription

Chemical Communications 2011, 47 (17), 4890-4892.
R. Wischert, C. Coperet, F. Delbecq, P. Sautet
"Dinitrogen: A Selective Probe for Tri-Coordinate Al "Defect" Sites on Alumina".
Abstract; full text via subscription

Chemical communications 2011, 47(20), 5861-3.
Perraud Olivier; Martinez Alexandre; Dutasta Jean-Pierre
"Exclusive enantioselective recognition of glucopyranosides by inherently chiral hemicryptophanes"

Chemical Physics Letters 2011, 501 (4-6), 245-251.
E. Dumont, A. D. Laurent, X. Assfeld, D. Jacquemin
"Performances of Recently-Proposed Functionals for Describing Disulfide Radical Anions and Similar Systems".
Abstract; full text via subscription

Chemistry 2011, 17(15), 4177-82.
Perraud Olivier; Robert Vincent; Martinez Alexandre; Dutasta Jean-Pierre
"The cooperative effect in ion-pair recognition by a ditopic hemicryptophane host"

Chemistry 2011, 17(48), 13405-8.
Perraud Olivier; Robert Vincent; Martinez Alexandre; Dutasta Jean-Pierre
A designed cavity for zwitterionic species: selective recognition of taurine in aqueous media

Chemistry - A European Journal 2011, 17(48), 13405-13408.
Perraud, Olivier; Robert, Vincent; Martinez, Alexandre; Dutasta, Jean-Pierre
"A Designed Cavity for Zwitterionic Species: Selective Recognition of Taurine in Aqueous Media"

Chemistry - A European Journal 2011, 17(15), 4177-4182.
Perraud, Olivier; Robert, Vincent; Martinez, Alexandre; Dutasta, Jean-Pierre
"The Cooperative Effect in Ion-Pair Recognition by a Ditopic Hemicryptophane Host"

Chemistry - A European Journal 2011, 17(50), 14288-14299, S14288/1-S14288/8.
Auneau, Florian; Michel, Carine; Delbecq, Francoise; Pinel, Catherine; Sautet, Philippe
"Unravelling the Mechanism of Glycerol Hydrogenolysis over Rhodium Catalyst through Combined Experimental-Theoretical Investigations".

Chemistry of Materials 2011, 23(3), 862-873.
Massin, Julien; Dayoub, Wissam; Mulatier, Jean-Christophe; Aronica, Christophe; Bretonniere, Yann; Andraud, Chantal
"Near-Infrared Solid-State Emitters Based on Isophorone: Synthesis, Crystal Structure and Spectroscopic Properties"

Chemistry of Materials 2011, 23, 3228–3236.
N. Rendon, A. Bourdolle, P. L. Baldeck, H. Le Bozec, C. Andraud, S. Brasselet, C. Copéret, O. Maury
"Bright luminescent silica nanoparticles for two-photon microscopy imaging via controlled formation of 4,4’-diethylaminostyryl-2,2’-bipyridine Zn(II) surface complexes".

Chemphyschem 2011, 12 (14), 2596-2603.
E. Dumont, C. Michel, P. Sautet
"Unraveling Gold(I)-Specific Action Towards Peptidic Disulfide Cleavage: A Dft Investigation"
Abstract; full text via subscription

Dalton Transactions 2011, 40 (37), 9608-9618.
G. S. Matouzenko, E. Jeanneau, A. Y. Verat, A. Bousseksou
"Spin Crossover and Polymorphism in a Family of 1,2-Bis(4-Pyridyl)Ethene-Bridged Binuclear Iron(Ii) Complexes. A Key Role of Structural Distortions"
Abstract; full text via subscription

Electrochimica Acta 2011, 56(28), 10842-10856.
Ferreira de Morais, Rodrigo; Sautet, Philippe; Loffreda, David; Franco, Alejandro A.
"A multiscale theoretical methodology for the calculation of electrochemical observables from ab initio data: Application to the oxygen reduction reaction in a Pt(1 1 1)-based polymer electrolyte membrane fuel cell".

European Physical Journal B 2011, 80 (2), 189-193.
L. S. Li, W. Chen, W. Dong, X. S. Chen
"Critical Behavior of Two-Dimensional Magnetic Lattice Gas Model".
Abstract; full text via subscription

Inorganic Chemistry 2011, 50 (21), 11143-11151.
E. M. Zueva, E. R. Ryabikh, S. A. Borshch
"Theoretical Analysis of Spin Crossover in Iron(Ii) 2 X 2 Molecular Grids".
Abstract; full text via subscription

Inorganic Chemistry 2011, 50 (23), 11896-11904.
Belanzoni, Paola; Michel, Carine; Baerends, Evert Jan
"Cu(Bipy)(2+)/Tempo-Catalyzed Oxidation of Alcohols: Radical or Nonradical Mechanism?"
Abstract; full text via subscription

Inorganic Chemistry 2011, 50 (5), 1905-1913.
E. M. Zueva, E. R. Ryabikh, A. M. Kuznetsov, S. A. Borshch
"Spin Crossover in Tetranuclear Cyanide-Bridged Iron(Ii) Square Complexes: A Theoretical Study".
Abstract; full text via subscription

Inorganic Chemistry 2011, 50(11), 4987-4999.
Bourdolle, Adrien; Allali, Mustapha; Mulatier, Jean-Christophe; Le Guennic, Boris; Zwier, Jurriaan M.; Baldeck, Patrice L.; Bunzli, Jean-Claude G.; Andraud, Chantal; Lamarque, Laurent; Maury, Olivier
"Modulating the Photophysical Properties of Azamacrocyclic Europium Complexes with Charge-Transfer Antenna Chromophores".

Journal of Chemical Physics 2011, 134 (11).
C. Isvoranu, J. Knudsen, E. Ataman, K. Schulte, B. Wang, M. L. Bocquet, J. N. Andersen, J. Schnadt
"Adsorption of Ammonia on Multilayer Iron Phthalocyanine".
Abstract; full text via subscription

Journal of Catalysis 2011, 278 (2), 239-245.
C. Dupont, F. Delbecq, D. Loffreda, Y. Jugnet
"Preferential Co Oxidation in a Large Excess of Hydrogen on Pt3sn Surfaces".
Abstract; full text via subscription

 Journal of Chemical Physics  2011, 134 (11).
C. Isvoranu, B. Wang, E. Ataman, K. Schulte, J. Knudsen, J. N. Andersen, M. L. Bocquet, J. Schnadt
"Ammonia Adsorption on Iron Phthalocyanine on Au(111): Influence on Adsorbate-Substrate Coupling and Molecular Spin".
Abstract; full text via subscription

 Journal of Chemical Physics  2011, 134 (7).
T. Patsahan, M. Holovko, W. Dong
"Fluids in Porous Media. Iii. Scaled Particle Theory".
Abstract; full text via subscription

Journal of Materials Chemistry 2011, 21(46), 18613-18622.
Philippot, Cecile; Bourdolle, Adrien; Maury, Olivier; Dubois, Fabien; Boury, Bruno; Brustlein, Sophie; Brasselet, Sophie; Andraud, Chantal; Ibanez, Alain
"Doped silica nanoparticles containing two-photon luminescent Eu(III) complexes for the development of water stable bio-labels".

 Journal of Medicinal Chemistry  2011, 54 (12), 4274-4278.
J. Hasserodt, F. Touti, J. Kolanowski, A. Singh, R. Steinhoff, P. Maurin, L. Canaple, O. Beuf, J. Samarut
"Progress in the Design of Iron (Ii)-Based Probes to Highlight Enzyme Activity in Magnetic Resonance Images".

Journal of Medicinal Chemistry 2011, 54(12), 4274-4278.
F. Touti, A. K. Singh, P. Maurin, L. Canaple, O. Beuf, J. Samarut, J. Hasserodt
"An Electroneutral Macrocyclic Iron(II) Complex That Enhances MRI Contrast in Vivo""
Abstract; full text via subscription

 Journal of Physical Chemistry  A  2011, 115 (35), 10106-10112.
N. Cheron, L. El Kaim, L. Grimaud, P. Fleurat-Lessard
"A Density Functional Theory Study of the Nef-Isocyanide Reaction: Mechanism, Influence of Parameters and Scope".
Abstract; full text via subscription

Journal of Physical Chemistry B 2011, 115 (26), 8545-8558.
J. Garrec, P. Sautet, P. Fleurat-Lessard
"Understanding the Hiv-1 Protease Reactivity with Dft: What Do We Gain from Recent Functionals?"
Abstract; full text via subscription

Journal of Physical Chemistry B 2011, 115 (50), 15138-15144.
C. Dupont, C. Patel, E. Dumontt
"Improved Dft Description of Intrastrand Cross-Link Formation by Inclusion of London Dispersion Corrections".
Abstract; full text via subscription

Journal of Physical Chemistry B 2011, 115 (20), 6776-6783.
E. Dumont, N. Ferre
"Geometrical Embedding Governs a Dramatic Variation of Electron Paramagnetic Resonance Hyperfine Coupling Constants of Disulfide Radical Anions"
Abstract; full text via subscription

Journal of Physical Chemistry C 2011, 115 (50), 24718-24727.
C. Isvoranu, B. Wang, E. Ataman, J. Knudsen, K. Schulte, J. N. Andersen, M. L. Bocquet, J. Schnadt
"Comparison of the Carbonyl and Nitrosyl Complexes Formed by Adsorption of Co and No on Mono Layers of Iron Phthalocyanine on Au(111)"
Abstract; full text via subscription

Journal of Physics-Condensed Matter 2011, 23 (23).
D. Coslovich, G. Kahl, V. Krakoviack
"Complex Dynamics of Fluids in Disordered and Crowded Environments Preface"
Abstract; full text via subscription

Journal of Physical Chemistry C 2011, 115 (41), 20201-20208.
C. Isvoranu, B. Wang, E. Ataman, K. Schulte, J. Knudsen, J. N. Andersen, M. L. Bocquet, J. Schnadt
"Pyridine Adsorption on Single-Layer Iron Phthalocyanine on Au(111)".
Abstract; full text via subscription

Journal of Physical Chemistry C 2011, 115 (14), 6757-6763.
M. Delgado, C. C. Santini, F. Delbecq, A. Baudouin, A. De Mallmann, C. Prestipino, S. Norsic, P. Sautet, J. M. Basset
"Characterization of Surface Hydride Hafnium Complexes on Alumina by a Combination of Experiments and Dft Calculations".
Abstract; full text via subscription

Journal of Physical Chemistry C 2011, 115 (39), 19394-19404.
M. Harb, P. Sautet, P. Raybaud
"Origin of the Enhanced Visible-Light Absorption in N-Doped Bulk Anatase Tio(2) from First-Principles Calculations".
Abstract; full text via subscription

Journal of Physical Chemistry Letters  2011 , 2 (18), 2341-2345.
B. Wang, M. L. Bocquet
"Monolayer Graphene and H-Bn on Metal Substrates as Versatile Templates for Metallic Nanoclusters"
Abstract; full text via subscription

Journal of Synchrotron Radiation    2011  , 18, 74-78.
R. Talon, R. Kahn, M. Asunción Dura, O. Maury, F. M. D. Vellieux, B. Franzetti, E. Girard
"Phasing of large macromolecular assemblies: use oflanthanide complexes".

Journal of the American Chemical Society 2011 133 (7), pp 2157-2159.
P. Dimitrov Raytchev, A. Martinez, H. Gornitzka, and J-P. Dutasta
"Encaging the Verkade's Superbases: Thermodynamic and Kinetic Consequences".

Journal of the American Chemical Society 2011, 133, 6174–6176.
E. Di Piazza, L. Norel, K. Costuas, A. Bourdolle, O. Maury, S. Rigaut
"d-f Heterobimetallic Association Between Ytterbium and Ruthenium Carbon-Rich Complex: Redox.

Langmuir 2011, 27, 9, 5555-5561.
F. Chaput, F. Lerouge, S. Tusseau-Nenez, P.-E. Coulon, C. Dujardin, S. Denis-Quanquin, F. Mpambani, S. Parola
"Rare earth fluoride nanoparticles obtained using charge transfer complexes. A versatile and efficient route towards colloïdal suspensions and monolithic transparent xerogels"Commutation of NIR Luminescence".

Microporous and Mesoporous Materials 2011, 139, 52–58.
F. Chassagneux, R. Chiriac, F. Bessueille, M. Karabulut, L. Bois, S. Parola
"Ellipsoporosimetry and thermoporometry analyses of mesoporous titania film containing silver nanoparticles".

La Recherche 2011, 452(mai), 15.
Marie-Laure Bocquet
"Deux molécules de gaz transportées au lieu d'une ?".

Nano Letters 2011, 11(5), 2043-2047.
S. Zaiba, F. Lerouge, A.-M. Gabudean, M. Iosin, J. Lermé, T. Gallavardin, O. Maury, C. Andraud, S. Parola, P. L. Baldeck
"Transparent plasmonic nano-containers protect organic fluorophores against photobleaching".
in the web

Nano Letters 2011, 11 (5), 1895-1900.
S. Gunther, S. Danhardt, B. Wang, M. L. Bocquet, S. Schmitt, J. Wintterlin
"Single Terrace Growth of Graphene on a Metal Surface".
Abstract; full text via subscription

Nature Chemistry 2011, 3 (2), 114-119.
K. Seufert, M. L. Bocquet, W. Auwarter, A. Weber-Bargioni, J. Reichert, N. Lorente, J. V. Barth
"Cis-Dicarbonyl Binding at Cobalt and Iron Porphyrins with Saddle-Shape Conformation".
Abstract; full text via subscription in the web1      in the web2

Optical Materials 2011, 33, 9, 1377-1381.
A.-M. Gabudean, F. Lerouge, T. Gallavardin, M. Iosin, S. Zaiba, O. Maury, P. L. Baldeck, C. Andraud, S. Parola
"Synthesis and optical properties of dyes encapsulated in gold hollow nanoshells"

Organic and biomolecular chemistry 2011, 9(14), 5086-91.
Vachon Jerome; Harthong Steven; Jeanneau Erwann; Aronica Christophe; Vanthuyne Nicolas; Roussel Christian; Dutasta Jean-Pierre
"Inherently chiral phosphonatocavitands as artificial chemo- and enantio-selective receptors of natural ammoniums"

Organic and Biomolecular Chemistry 2011 in press
O. Perraud, V. Robert, H. Gornitzka, A. Martinez, J.-P. Dutasta
"Hemicryptophane host as efficient primary alkylammonium ion receptor"

Organic Letters 2011, 13, 3706-3709.
B. Chatelet, E. Payet, O. Perraud, P. Dimitrov Raytchev, L.-L. Chapellet, V. Dufaud, A. Martinez, J.-P. Dutasta
"Shorter and Modular Synthesis of Hemicryptophane-tren Derivatives"

Organic Letters 2011, 13, 22-25.
Q. Bellier, S. Pégaz, C. Aronica, B. Le Guennic, C Andraud, O. Maury
"Near-Infrared Nitrofluorene Substitued Aza-Boron-dipyrromethenes Dyes."

Photochemical and Photobiological Sciences 2011, 10, 7, 1216-1225.
T. Gallavardin, M. Maurin, T. Simon, A.-M. Gabudean, Y. Bretonnière, O. Maury, P. L. Baldeck, O. Stéphan, Y. Leverrier, S. Marotte, J. Marvel, M. Lindgren, F. Lerouge, S. Parola, C. Andraud
"Photodynamic therapy and two-photon bio-imaging applications of hydrophobic chromophores through amphiphilic polymers vectorisation".

Physical Chemistry Chemical Physics 2011, 13 (4), 1448-1456.
D. Coll, F. Delbecq, Y. Aray, P. Sautet
"Stability of Intermediates in the Glycerol Hydrogenolysis on Transition Metal Catalysts from First Principles".
Abstract; full text via subscription

Physical Chemistry Chemical Physics 2011, 13, 854-863.
C. Stoeffler, B. Darquié, A. Shelkovnikov, C. Daussy, A. Amy-Klein, C. Chardonnet, L. Guy, J. Crassous, T. R. Huet, P. Soulard and P. Asselin,
High resolution spectroscopy of methyltrioxorhenium: towards the observation of parity violation in chiral molecules.

Physical Chemistry Chemical Physics 2011, 13 (13), 6000-6009.
J. Haubrich, D. Loffreda, F. Delbecq, P. Sautet, Y. Jugnet, A. Krupski, C. Becker, K. Wandelt
"Mechanistic and Spectroscopic Identification of Initial Reaction Intermediates for Prenal Decomposition on a Platinum Model Catalyst"
Abstract; full text via subscription

Physical Chemistry Chemical Physics 2011, 13 (25), 11827-11837.
S. Laref, Y. Li, M. L. Bocquet, F. Delbecq, P. Sautet, D. Loffreda
"Nature of Adhesion of Condensed Organic Films on Platinum by First-Principles Simulations"
Abstract; full text via subscription

Physical Chemistry Chemical Physics 2011, 13 (35), 15955-15959.
X. Rozanska, P. Sautet, F. Delbecq, F. Lefebvre, S. Borshch, H. Chermette, J. M. Basset, E. Grinenval
"Polyoxometalate Grafting onto Silica: Stability Diagrams of H(3)Pmo(12)O(40) on {001}, {101}, and {111} Beta-Cristobalite Surfaces Analyzed by Dft".
Abstract; full text via subscription

Physical Review B 2011, 83 (12).
Y. Xiao, W. Dong
"Molecular Dynamics Simulation of a Complex Surface Reaction: The Effect of Coverage on H-2 Dissociation on Pd(111)"
Abstract; full text via subscription

Physical Review E 2011, 84 (5).
V. Krakoviack
"Mode-Coupling Theory Predictions for the Dynamical Transitions of Partly Pinned Fluid Systems"
Abstract; full text

Surface Science 2011, 605 (17-18), 1676-1684.
E. Sutter, P. Albrecht, B. Wang, M. L. Bocquet, L. J. Wu, Y. M. Zhu, P. Sutter
"Arrays of Ru Nanoclusters with Narrow Size Distribution Templated by Monolayer Graphene on Ru"
Abstract; full text via subscription

Tetrahedron 2011, 67, 976-981.
M. Genelot, V. Dufaud, L. Djakovitch
"Heterogeneous metallo-organocatalysis for the selective one-pot synthesis of 2-benzylidene-indoxyl and 2-phenyl-4-quinolone".

Books

P.-A. Bouit, O. Maury, P. Feneyrou, S. Parola, F. Kajzar and C. Andraud. "Multiphotonic absorption for optical power limiting" in Multiphoton processes in organic materials and their applications, 2011 Rau I. and Kajzar F., Eds, Archives Contemporaines & Old City Publishing, Paris – Philadelphia, pp. 275-333.

Patents

PCT Int. Appl. (2011), WO 2011128338 A1 20111020.
Chaput, Frederic; Parola, Stephane; Lopes, Cesar; Chateau, Denis; Desroches, Cedric
"Preparation of organic-inorganic hybrid materials by fast condensation of organosilicon sols".