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51

Effective Group Potentials. 1. Method

Poteau, Romuald, Ortega, Ivan, Alary, Fabienne, Solis, Alejandro Ramirez, Barthelat, Jean-Claude, Daudey, Jean-Pierre

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 81 KB

english, 2001

52

Effective Group Potentials. 2. Extraction and Transferability for Chemical Groups Involved in Covalent or Donor−Acceptor Bonds

Poteau, Romuald, Alary, Fabienne, Abou El Makarim, Hassna, Heully, Jean-Louis, Barthelat, Jean-Claude, Daudey, Jean-Pierre

Journal:

Journal of Physical Chemistry A

Year:

2001

Language:

english

File:

PDF, 97 KB

english, 2001

53

Dimeric Gold Bis(carbene) Complexes by Transmetalation in Water

Cure, Jérémy, Poteau, Romuald, Gerber, Iann C., Gornitzka, Heinz, Hemmert, Catherine

Journal:

Organometallics

Year:

2012

Language:

english

File:

PDF, 432 KB

english, 2012

54

A Density Functional Theory Study of Spectroscopic and Thermodynamic Properties of Surfacic Hydrides on Ru (0001) Model Surface: The Influence of the Coordination Modes and the Coverage

del Rosal, Iker, Truflandier, Lionel, Poteau, Romuald, Gerber, Iann C.

Journal:

The Journal of Physical Chemistry C

Year:

2011

Language:

english

File:

PDF, 3.30 MB

english, 2011

55

From Molecular Complexes to Complex Metallic Nanostructures- 2 H Solid-State NMR Studies of Ruthenium-Containing Hydrogenation Catalysts

Gutmann, Torsten, del Rosal, Iker, Chaudret, Bruno, Poteau, Romuald, Limbach, Hans-Heinrich, Buntkowsky, Gerd

Journal:

Year:

2013

Language:

english

File:

PDF, 909 KB

english, 2013

56

Theoretical Study of Ln(III) Complexes with Polyaza-Aromatic Ligands: Geometries of [LnL(H 2 O) n ] 3+ Complexes and Successes and Failures of TD-DFT

Gutierrez, F., Rabbe, C., Poteau, R., Daudey, J. P.

Journal:

Journal of Physical Chemistry A

Year:

2005

Language:

english

File:

PDF, 254 KB

english, 2005

57

2H NMR calculations on polynuclear transition metal complexes: on the influence of local symmetry and other factors

del Rosal, Iker, Gutmann, Torsten, Walaszek, Bernadeta, Gerber, Iann C., Chaudret, Bruno, Limbach, Hans-Heinrich, Buntkowsky, Gerd, Poteau, Romuald

Journal:

Physical Chemistry Chemical Physics

Year:

2011

Language:

english

File:

PDF, 2.47 MB

english, 2011

58

Structural properties of sodium microclusters (n=4–34) using a Monte Carlo growth method

Poteau, Romuald, Spiegelmann, Fernand

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.77 MB

english, 1993

59

Ligand-Field Theory-Based Analysis of the Adsorption Properties of Ruthenium Nanoparticles

del Rosal, Iker, Mercy, Maxime, Gerber, Iann C., Poteau, Romuald

Journal:

Year:

2013

Language:

english

File:

PDF, 4.17 MB

english, 2013

60

Influence of pH on Stability and Dynamic Properties of Asphaltenes and Other Amphiphilic Molecules at the Oil−Water Interface †

Poteau, Sandrine, Argillier, Jean-François, Langevin, Dominique, Pincet, Frédéric, Perez, Eric

Journal:

Year:

2005

Language:

english

File:

PDF, 218 KB

english, 2005

61

Seasonal dynamics in colored dissolved organic matter in the Mediterranean Sea: Patterns and drivers

Xing, Xiaogang, Claustre, Hervé, Wang, Haili, Poteau, Antoine, D‘Ortenzio, Fabrizio

Journal:

Deep Sea Research Part I: Oceanographic Research Papers

Year:

2014

Language:

english

File:

PDF, 4.91 MB

english, 2014

62

Retrieval of the seawater reflectance for suspended solids monitoring in the East China Sea using MODIS, MERIS and GOCI satellite data

Doxaran, David, Lamquin, Nicolas, Park, Young-Je, Mazeran, Constant, Ryu, Joo-Hyung, Wang, Menghua, Poteau, Antoine

Journal:

Remote Sensing of Environment

Year:

2014

Language:

english

File:

PDF, 5.60 MB

english, 2014

63

Dinuclear gold(I) and gold(III) complexes involving di(N-heterocyclic carbene) ligands – Synthesis, characterization and DFT studies

Hemmert, Catherine, Poteau, Romuald, Laurent, Manon, Gornitzka, Heinz

Journal:

Journal of Organometallic Chemistry

Year:

2013

Language:

english

File:

PDF, 1.29 MB

english, 2013

64

The Poetics of Death: The Short Prose of Kleist and Balzacby Beatrice Martina Guenther

Review by: Mary L. Poteau-Tralie

Journal:

Nineteenth Century French Studies

Year:

1997-1998

Language:

english

File:

PDF, 436 KB

english, 1997-1998

65

Investigation of the Optical Backscattering to Scattering Ratio of Marine Particles in Relation to Their Biogeochemical Composition in the Eastern English Channel and Southern North Sea

Hubert Loisel Xavier Mériaux, Jean-François Berthon and Antoine Poteau

Journal:

Limnology and Oceanography

Year:

2007

Language:

english

File:

PDF, 2.35 MB

english, 2007

66

All- cis Cyclic Peptides

Poteau, Romuald, Trinquier, Georges

Journal:

Journal of the American Chemical Society

Year:

2005

Language:

english

File:

PDF, 469 KB

english, 2005

67

All- cis Helical Polypeptides

Poteau, Romuald, Trinquier, Georges

Journal:

Journal of Organic Chemistry

Year:

2007

Language:

english

File:

PDF, 541 KB

english, 2007

68

Maupassant: Espaces du romanby Claudine Giacchetti

Review by: Mary L. Poteau-Tralie

Journal:

South Atlantic Review

Year:

1994

Language:

english

File:

PDF, 357 KB

english, 1994

69

Ultrafast Measurements of Charge and Excited-State Intramolecular Proton Transfer in Solutions of 4‘-( N,N -Dimethylamino) Derivatives of 3-Hydroxyflavone

Ameer-Beg, Simon, Ormson, Stuart M., Poteau, Xavier, Brown, Robert G., Foggi, Paolo, Bussotti, Laura, Neuwahl, Frederik V. R.

Journal:

Journal of Physical Chemistry A

Year:

2004

Language:

english

File:

PDF, 186 KB

english, 2004

70

Estimating the “Steric Clash” at cis Peptide Bonds

Mathieu, Simon, Poteau, Romuald, Trinquier, Georges

Journal:

Journal of Physical Chemistry B

Year:

2008

Language:

english

File:

PDF, 555 KB

english, 2008

71

Grafting of Lanthanide Complexes on Silica Surfaces: A Theoretical Investigation

Iker, Del Rosal, Iann C., Gerber, Romuald, Poteau, Laurent, Maron

Journal:

Journal of Physical Chemistry A

Year:

2010

Language:

english

File:

PDF, 4.03 MB

english, 2010

72

Surfaces of a Colloidal Iron Nanoparticle in Its Chemical Environment: A DFT Description

Fischer, Guntram, Poteau, Romuald, Lachaize, Sébastien, Gerber, Iann C.

Journal:

Year:

2014

Language:

english

File:

PDF, 614 KB

english, 2014

73

Using Effective Group Potential Methodology for Predicting Organometallic Complex Properties

Alary, Fabienne, Heully, Jean-Louis, Poteau, Romuald, Maron, Laurent, Trinquier, Georges, Daudey, Jean-Pierre

Journal:

Journal of the American Chemical Society

Year:

2003

Language:

english

File:

PDF, 239 KB

english, 2003

74

Recent Progress in Atomic and Chemical Group Effective Potentials

Maron, L., Teichteil, C., Poteau, R., Alary, F.

Journal:

Journal of Chemical Information and Modeling

Year:

2001

Language:

english

File:

PDF, 56 KB

english, 2001

75

Modeling a Carbonyl Group Taking into Account Back-Donation Effects through the Effective Group Potential Method

Bessac, Fabienne, Alary, Fabienne, Poteau, Romuald, Heully, Jean-Louis, Daudey, Jean-Pierre

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 230 KB

english, 2003

76

Modeling C 5 H 5 with Atoms or Effective Group Potential in Lanthanide Complexes: Isolobality Not the Determining Factor

Maron, Laurent, Eisenstein, Odile, Alary, Fabienne, Poteau, Romuald

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 45 KB

english, 2002

77

Ligand effect on the NMR, vibrational and structural properties of tetra- and hexanuclear ruthenium hydrido clusters: a theoretical investigation

del Rosal, I., Jolibois, F., Maron, L., Philippot, K., Chaudret, B., Poteau, R.

Journal:

Dalton Transactions

Year:

2009

Language:

english

File:

PDF, 684 KB

english, 2009

78

Tin-decorated ruthenium nanoparticles: a way to tune selectivity in hydrogenation reaction

Bonnefille, Eric, Novio, Fernando, Gutmann, Torsten, Poteau, Romuald, Lecante, Pierre, Jumas, Jean-Claude, Philippot, Karine, Chaudret, Bruno

Journal:

Year:

2014

Language:

english

File:

PDF, 731 KB

english, 2014

79

Propensity for local folding induced by the urea fragment in short-chain oligomers

Fischer, Lucile, Didierjean, Claude, Jolibois, Franck, Semetey, Vincent, Manuel Lozano, Jose, Briand, Jean-Paul, Marraud, Michel, Poteau, Romuald, Guichard, Gilles

Journal:

Organic & Biomolecular Chemistry

Year:

2008

Language:

english

File:

PDF, 783 KB

english, 2008

80

Quantum chemistry-based interpretations on the lowest triplet state of luminescent lanthanides complexes. Part 1. Relation between the triplet state energy of hydroxamate complexes and their luminescence properties

Gutierrez, Fabien, Tedeschi, Christine, Maron, Laurent, Daudey, Jean-Pierre, Poteau, Romuald, Azema, Jo�lle, Tisn�s, Pierre, Picard, Claude

Journal:

Dalton Transactions

Year:

2004

Language:

english

File:

PDF, 361 KB

english, 2004

81

Absorption and solvatochromic properties of 2-methylisoindolin-1-one and related compounds: interplay between theory and experiments

Gutierrez, Fabien, Trzcionka, J�r�me, Deloncle, Rodolphe, Poteau, Romuald, Chouini-Lalanne, Nadia

Journal:

New Journal of Chemistry

Year:

2005

Language:

english

File:

PDF, 900 KB

english, 2005

82

DFT study of the Ring Opening Polymerization of ε-caprolactone by grafted lanthanide complexes: 1—Effect of the grafting mode on the reactivity of borohydride complexes

Rosal, Iker Del, Poteau, Romuald, Maron, Laurent

Journal:

Dalton Transactions

Year:

2011

Language:

english

File:

PDF, 1.66 MB

english, 2011

83

Theoretical proposal for an organometallic route to cis-peptides

Chaudret, Robin, Trinquier, Georges, Poteau, Romuald, Maron, Laurent

Journal:

New Journal of Chemistry

Year:

2009

Language:

english

File:

PDF, 1.03 MB

english, 2009

84

DFT study of the Ring Opening Polymerization of ε-caprolactone by grafted lanthanide complexes: 2—Effect of the initiator ligand

Rosal, Iker Del, Poteau, Romuald, Maron, Laurent

Journal:

Dalton Transactions

Year:

2011

Language:

english

File:

PDF, 1.26 MB

english, 2011

85

DFT calculations of 29Si-NMR chemical shifts in Ru(ii) silyl complexes: Searching for trends and accurate values

Poblador-Bahamonde, A. I., Poteau, R., Raynaud, C., Eisenstein, O.

Journal:

Dalton Transactions

Year:

2011

Language:

english

File:

PDF, 524 KB

english, 2011

86

Spectroscopic and theoretical studies of the excited states of fenofibric acid and ketoprofen in relation with their photosensitizing properties

Lhiaubet, Virginie, Gutierrez, Fabien, Penaud–Berruyer, Florence, Amouyal, Edmond, Daudey, Jean-Pierre, Poteau, Romuald, Chouini–Lalanne, Nadia, Paillous, Nicole

Journal:

New Journal of Chemistry

Year:

2000

Language:

english

File:

PDF, 344 KB

english, 2000

87

DFT calculations of 1H and 13C NMR chemical shifts in transition metal hydrides

del Rosal, I., Maron, L., Poteau, R., Jolibois, F.

Journal:

Dalton Transactions

Year:

2008

Language:

english

File:

PDF, 325 KB

english, 2008

88

The effective group potential, a new method for the study of spectrum in large molecules: Tests and perspectives

Heully, Jean-Louis, Poteau, Romuald, Berasaluce, Sandra, Alary, Fabienne

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 595 KB

english, 2002

89

Distance-dependent Hückel-type model for the study of sodium clusters

Poteau, Romuald, Spiegelmann, Fernand

Journal:

Physical Review B

Year:

1992

Language:

english

File:

PDF, 621 KB

english, 1992

90

Comparative studies of the spectroscopy of CuCl[sub 2]: DFT versus standard ab initio approaches

Ramı́rez-Solı́s, A., Poteau, R., Vela, A., Daudey, J. P.

Journal:

The Journal of Chemical Physics

Year:

2005

Language:

english

File:

PDF, 353 KB

english, 2005

91

Ultrathin Gold Nanowires: Soft-Templating versus Liquid Phase Synthesis, a Quantitative Study

Loubat, Anaïs, Lacroix, Lise-Marie, Robert, Antoine, Impéror-Clerc, Marianne, Poteau, Romuald, Maron, Laurent, Arenal, Raul, Pansu, Brigitte, Viau, Guillaume

Journal:

The Journal of Physical Chemistry C

Year:

2015

Language:

english

File:

PDF, 5.09 MB

english, 2015

92

Erratum: Structural properties of sodium microclusters (n=4−34) using a Monte Carlo growth method [J. Chem. Phys. 98, 6540 (1993)]

Poteau, Romuald, Spiegelmann, Fernand

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 423 KB

english, 1993

93

Analytical Interference in Serum Iron Determination Reveals Iron Versus Gadolinium Transmetallation With Linear Gadolinium-Based Contrast Agents

Fretellier, Nathalie, Poteau, Nathalie, Factor, Cécile, Mayer, Jean-François, Medina, Christelle, Port, Marc, Idée, Jean-Marc, Corot, Claire

Journal:

Investigative Radiology

Year:

2014

Language:

english

File:

PDF, 1.37 MB

english, 2014

94

SPIE Proceedings [SPIE OPTO Ireland - Galway, Ireland (Thursday 5 September 2002)] Opto-Ireland 2002: Optics and Photonics Technologies and Applications - Ratiometric sensor for dissolved oxygen in seawater

Poteau, Xavier, MacCraith, Brian D., Glynn, Thomas J.

Year:

2003

Language:

english

File:

PDF, 198 KB

english, 2003

95

Yttrium Dihydride Cation [YH 2 (THF) 2 ] +n : Aggregate Formation and Reaction with (NNNN)-Type Macrocycles

Arndt, Stefan, Kramer, Mathias U., Fegler, Waldemar, Nakajima, Yumiko, Del Rosal, Iker, Poteau, Romuald, Spaniol, Thomas P., Maron, Laurent, Okuda, Jun

Journal:

Organometallics

Year:

2015

Language:

english

File:

PDF, 2.26 MB

english, 2015

96

Grafting of lanthanide complexes on silica surfaces dehydroxylated at 200°C : A theoretical investigation

del Rosal, Iker, Gerber, Iann, Poteau, Romuald, Maron, Laurent

Journal:

New Journal of Chemistry

Year:

2015

Language:

english

File:

PDF, 2.37 MB

english, 2015

97

The electronic spectrum of AgCl[sub 2]: Ab initio benchmark versus density-functional theory calculations on the lowest ligand-field states including spin-orbit effects

Ramírez-Solís, A., Poteau, R., Daudey, J. P.

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 147 KB

english, 2006

98

An ab initio study of mutual neutralization in Na + +H - collisions

Dickinson, A S, Poteau, R, Gadéa, F X

Journal:

Journal of Physics B Atomic Molecular and Optical Physics

Year:

1999

Language:

english

File:

PDF, 591 KB

english, 1999

99

The Centenarian, or, The Two Beringheldsby Horace de Saint-Aubin; Honoré de Balzac; Danièle Chatelain; George Slusser

Review by: Mary Poteau-Tralie

Journal:

Nineteenth Century French Studies

Year:

2007

Language:

english

File:

PDF, 293 KB

english, 2007

100

Benchmarking thrift and mortgage finance companies

Malhotra, D.K., Poteau, Raymond, Fritz, Joseph J.

Journal:

International Journal of Data Analysis Techniques and Strategies

Year:

2015

Language:

english

File:

PDF, 303 KB

english, 2015

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