Aurélien Moncomble

Maître de conférences - Theoretical chemistry
CNU : SECTION 31 - CHIMIE THEORIQUE, PHYSIQUE, ANALYTIQUE
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Aurélien Moncomble

Maître de conférences - Theoretical chemistry

Publications

Article dans des revues

  • Lucas Mangold, Hubert Halleux, Sébastien Leclerc, Aurélien Moncomble, Gérard Cote, et al.. New insights for titanium(iv) speciation in acidic media based on UV-visible and 31P NMR spectroscopies and molecular modeling. RSC Advances, Royal Society of Chemistry, 2021, 11 (43), pp.27059 - 27073. ⟨10.1039/d1ra04284j⟩. ⟨hal-03324044⟩
  • Luc Labarrière, Aurélien Moncomble, Jean-Paul Cornard. pH dependency of the structural and photophysical properties of the atypical 2′,3-dihydroxyflavone. RSC Advances, Royal Society of Chemistry, 2020, 10 (58), pp.35017-35030. ⟨10.1039/D0RA06833K⟩. ⟨hal-02963297⟩
  • Cyrille Gosset, Aurélien Moncomble, Clément Dumont, Sylvain Pellegrini, Till Bousquet, et al.. Photocatalyzed Amidoarylation of 1,3‐Butadiene. Advanced Synthesis and Catalysis, Wiley-VCH Verlag, 2020, 362 (15), pp.3100-3104. ⟨10.1002/adsc.202000071⟩. ⟨hal-02963037⟩
  • Erwan Beauvineau, Didier Bourissou, Elise Duboue-Dijon, Ludivine Garcia, Clément Guibert, et al.. Les IChO, de retour en France !. L'Actualité Chimique, Société chimique de France, 2020, 450, pp.40-43. ⟨hal-02965825⟩
  • Diksha Jani Thaviligadu, Luc Labarrière, Aurélien Moncomble, Jean-Paul Cornard. Spectroscopic and theoretical study of the pH effect on the optical properties of the calcium–morin system. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy [1994-..], Elsevier, 2020, 225, pp.117492. ⟨10.1016/j.saa.2019.117492⟩. ⟨hal-02963036⟩
  • Parth Patel, Juan J Arias, Renan Gongora, Florencio Hernandez, Aurélien Moncomble, et al.. Visible light-triggered fluorescence and pH modulation using metastable-state photoacids and BODIPY. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2018, 20 (42), pp.26804 - 26808. ⟨10.1039/C8CP03977A⟩. ⟨hal-01920077⟩
  • Aurélien Moncomble, Cécilia Falantin, Jean-Paul Cornard. Electronic Spectroscopies Combined with Quantum Chemistry Calculations: Study of the Interactions of 3-Hydroxyflavone with Copper Ions. Journal of Physical Chemistry B, American Chemical Society, 2018, 122 (38), pp.8943 - 8951. ⟨10.1021/acs.jpcb.8b06062⟩. ⟨hal-01920080⟩
  • Aurélien Moncomble, Diksha Jani Thaviligadu, Anaëlle Raoumbé Djendja, Jean-Paul Cornard. The crucial role of the inter-ring hydrogen bond to explain morin properties. New Journal of Chemistry, Royal Society of Chemistry, 2018, 42 (10), pp.7691 - 7702. ⟨10.1039/C7NJ04579D⟩. ⟨hal-01802543⟩
  • S. Sobanska, G. Billon, P. Coddeville, J.P. Cornard, Pascale Desgroux, et al.. Chimie et environnement. L'Actualité Chimique, Société chimique de France, 2017, 420, pp.23 - 28. ⟨hal-01586682⟩
  • A. Moncomble, J.P. Cornard, M. Meyer. A quantum chemistry evaluation of the stereochemical activity of the lone pair in PbII complexes with sequestering ligands. Journal of Molecular Modeling, Springer Verlag (Germany), 2017, 23 (1), pp.24. ⟨10.1007/s00894-016-3190-y⟩. ⟨hal-01505428⟩
  • Cécilia Falantin, Aurélien Moncomble, Annaïg Le Person, Jean-Paul Cornard. Chalcogen substitution: Effect of oxygen-by-sulfur exchange on structural and spectroscopic properties of flavonols. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy [1994-..], Elsevier, 2017, 187, pp.49 - 60. ⟨10.1016/j.saa.2017.06.022⟩. ⟨hal-01579861⟩
  • Yann Bourne-Branchu, Aurélien Moncomble, Martin Corpet, Grégory Danoun, Corinne Gosmini. Cobalt-Catalyzed Oxidative Homocoupling of Arylzinc Species. SYNTHESIS, Georg Thieme Verlag, 2016, 48 (19), pp.3352-3356. ⟨10.1055/s-0035-1562488⟩. ⟨hal-02000533⟩
  • K. Adjir, M. Sekkal-Rahal, A. Moncomble, J.P. Cornard. Spectral properties of α and β L Rhamno-Indigo molecules and activities prediction through NBO analysis. A DFT study. Zeitschrift für Physikalische Chemie, Oldenbourg Verlag, 2016, 230, pp.883 - 908. ⟨10.1515/zpch-2015-0709⟩. ⟨hal-01348658⟩
  • Vincent Tognetti, A. Moncomble. Les multiples visages des orbitales moléculaires. Bulletin de l'Union des Physiciens (1907-2003), Union des physiciens, 2016, 110, pp.1139-1165. ⟨hal-01389145⟩
  • Fatima Rebih, Manuel Andreini, A. Moncomble, Anne Harrison-Marchand, Jacques Maddaluno, et al.. Direct carboxylation of aryl tosylates by CO2 Catalyzed by In situ-generated Ni0. Chemistry - A European Journal, Wiley-VCH Verlag, 2016, 22 (11), pp.3758-3763. ⟨10.1002/chem.201503926⟩. ⟨hal-01285668⟩
  • A. Le Person, A. Moissette, M. Hureau, J.P. Cornard, A. Moncomble, et al.. Sorption of 3-hydroxyflavone within channel type zeolites: The effect of confinement on copper(II) complexation. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2016, 18, pp.26107 - 26116. ⟨10.1039/c6cp03839e⟩. ⟨hal-01388454⟩
  • A. Le Person, M. Siampiringue, M. Sarakha, A. Moncomble, J.P. Cornard. The photo-degradation of mesotrione, a triketone herbicide, in the presence of CuII ions. Journal of Photochemistry and Photobiology A: Chemistry, Elsevier, 2016, 315, pp.76 - 86. ⟨10.1016/j.jphotochem.2015.09.010⟩. ⟨hal-01222845⟩
  • G. Deblonde, A. Moncomble, G. Cote, S. Bélair, A. Chagnes. Experimental and computational exploration of the UV-visible properties of hexaniobate and hexatantalate ions. RSC Advances, Royal Society of Chemistry, 2015, 5, pp.7619 - 7627. ⟨10.1039/c4ra14866e⟩. ⟨hal-01135509⟩
  • S. Boumendil, J.P. Cornard, M. Sekkal-Rahal, A. Moncomble. Solvent effects to compute UV-vis spectra for ionic metal complexes. Chemical Physics Letters, Elsevier, 2015, 636, pp.39 - 45. ⟨10.1016/j.cplett.2015.07.019⟩. ⟨hal-01195978⟩
  • S. Brandès, A. Sornosa-Ten, Y. Rousselin, M. Lagrelette, C. Stern, et al.. Conformational and structural studies of N-methylacetohydroxamic acid and of its mono- and bis-chelated uranium(VI) complexes. Journal of Inorganic Biochemistry, Elsevier, 2015, 151, pp.164 - 175. ⟨10.1016/j.jinorgbio.2015.06.002⟩. ⟨hal-01244403⟩
  • A. Aillerie, V.L.D. Talancé, A. Moncomble, T. Bousquet, L. Pélinski. Enantioselective organocatalytic partial transfer hydrogenation of lactone-fused quinolines. Organic Letters, American Chemical Society, 2014, 16, pp.2982-2985. ⟨10.1021/ol5011196⟩. ⟨hal-01011275⟩
  • A. Moncomble, Vincent Tognetti. Fonctions de Fukui : un outil pour l'étude de la réactivité chimique. Le Bulletin de l'Union des Professeurs de Physique et de Chimie, Union des professeurs de physique et de chimie, 2014, 108, pp.239-254. ⟨hal-01063736⟩
  • A. Le Person, A. Moncomble, J.P. Cornard. The complexation of AlIII, PbII, and CuII metal ions by esculetin: a spectroscopic and theoretical approach. Journal of Physical Chemistry A, American Chemical Society, 2014, 118, pp.2646-2655. ⟨10.1021/jp412291z⟩. ⟨hal-00987575⟩
  • A. Moncomble, J.P. Cornard. Elucidation of complexation multi-equilibrium with MgII and a multisite ligand. A combined electronic spectroscopies and DFT investigation. RSC Advances, Royal Society of Chemistry, 2014, 4, pp.29050 - 29061. ⟨10.1039/C4RA05048G⟩. ⟨hal-01026228⟩
  • A. Chagnes, A. Moncomble, G. Cote. In-silico calculations as a helpful tool for designing new extractants in liquid-liquid extraction. Solvent Extraction and Ion Exchange, Taylor & Francis, 2013, 31, pp.499 - 518. ⟨10.1080/07366299.2013.775884⟩. ⟨hal-00860863⟩
  • G. Lewin, A. Maciuk, A. Moncomble, J.P. Cornard. Enhancement of the water solubility of flavone glycosides by disruption of molecular planarity of the aglycone moiety. Journal of Natural Products, American Chemical Society, 2013, 76, pp.8 - 12. ⟨10.1021/np300460a⟩. ⟨hal-00784343⟩
  • G Lewin, A Maciuk, Aurélien Moncomble, Jean-Paul Cornard. Emergence of high aqueous solubility for some flavone glycosides by disruption of molecular planarity. Planta Medica, Georg Thieme Verlag, 2012, 78 (11), ⟨10.1055/s-0032-1320392⟩. ⟨hal-03580022⟩
  • Aurelien Moncomble, Pascal Le Floch, Agusti Lledós, Corinne Gosmini. Cobalt-Catalyzed Vinylation of Aromatic Halides Using beta-Halostyrene: Experimental and DFT Studies. Journal of Organic Chemistry, American Chemical Society, 2012, 77, pp.5056-5062. ⟨10.1021/jo3005149⟩. ⟨hal-00905051⟩
  • S. Say-Liang-Fat, J.P. Cornard, A. Moncomble. Study on chrysazin-aluminium(III) interaction in solution by spectroscopy and quantum chemical calculations. Polyhedron, Elsevier, 2012, 48, pp.237 - 244. ⟨10.1016/j.poly.2012.08.067⟩. ⟨hal-00763654⟩
  • Amel Kadari, Aurélien Moncomble, Ilaria Ciofini, Méziane Brahimi, Carlo Adamo. Theoretical Study of Absorption and Emission Properties of Green and Yellow Emitting Iridium(III) Complexes. Journal of Physical Chemistry A, American Chemical Society, 2011, 115 (42), pp.11861-11865. ⟨10.1021/jp207008v⟩. ⟨hal-02963029⟩
  • Corinne Gosmini, Aurélien Moncomble. Cobalt-catalyzed Cross-coupling Reactions of aryl halides. Israel Journal of Chemistry, Wiley-VCH Verlag, 2010, pp.DOI: 10.1002/ijch.201000032. ⟨hal-00531445⟩
  • Corinne Gosmini, Aurélien Moncomble. Cobalt-catalysed cross-coupling reactions aryl halides (pub). Israel Journal of Chemistry, Wiley-VCH Verlag, 2010, 50, pp.568-576. ⟨hal-00577157⟩
  • Aurélien Moncomble, Pascal Le Floch, Corinne Gosmini. Cobalt-Catalyzed Formation of Symmetrical Biaryls and Its Mechanism. Chemistry - A European Journal, Wiley-VCH Verlag, 2009, 15, pp.4770-4774. ⟨hal-00385124⟩
  • Corinne Gosmini, Jeanne-Marie Begouin, Aurelien Moncomble. Cobalt-catalyzed cross-coupling reactions. Chemical Communications, Royal Society of Chemistry, 2008, 28, pp.3221-3233. ⟨hal-00305259⟩

Communication dans un congrès

  • Luc Labarrière, Aurélien Moncomble, Xavier Mercier, Jean-Paul Cornard. Electronic absorption energy and structure relationship in polycyclic aromatic hydrocarbon dimers. Rencontres de Chimie-Physique, Sep 2021, Sète, France. ⟨hal-03417438⟩
  • Lucas Mangold, Hubert Halleux, Aurélien Moncomble, Gérard Cote, Alexandre Chagnes. The speciation of titanium(IV) in concentrated phosphoric acid : A spectroscopical and TD-DFT study.. IUPAC CCCE 2021, Aug 2021, Ottawa (virtual), Canada. ⟨hal-03418105⟩
  • Luc Labarrière, Aurélien Moncomble, Xavier Mercier, Jean-Paul Cornard. Computational investigation of polycyclic aromatic hydrocarbon dimers as potential soot precursor candidates. Journées Nord Ouest Européennes des Jeunes Chercheurs, Jun 2021, Villeneuve d'Ascq, France. ⟨hal-03417430⟩
  • Luc Labarrière, Aurélien Moncomble, Jean-Paul Cornard. Mixed experimental and theoretical study of 2',3-dihydroxyflavone and its dual fluorescence. PhotOnline, Oct 2020, on line, France. ⟨hal-02998526⟩
  • Aurélien Moncomble, Diksha Jani Thaviligadu, Jean-Paul Cornard. Joined computational and experimental study of several 4th period cations-morin complexes. Current Trends in Theoretical Chemistry, Sep 2019, Cracovie, Poland. ⟨hal-02398004⟩
  • Diksha Jani Thaviligadu, Aurélien Moncomble, Jean-Paul Cornard. Electronic spectroscopic study of and quantum chemistry calculations on Ca2+-morin complexes. International Symposium on MEtal Complexes, Jun 2019, Debrecen, Hungary. ⟨hal-02398002⟩
  • Diksha Jani Thaviligadu, Aurélien Moncomble, Jean-Paul Cornard. Complexation des cations zinc, manganèse et calcium par des flavonols. Rencontres des Chimistes Théoriciens Francophones 2018, Oct 2018, Toulouse, France. ⟨hal-01909714⟩
  • Diksha Jani Thaviligadu, Aurélien Moncomble, Jean-Paul Cornard. Primary studies of the excited states of polycyclic aromatic hydrocarbons to decipher dual fluorescence. Journées Nord Ouest Européennes des Jeunes Chercheurs 2018, Jun 2018, Villeneuve d’Ascq, France. ⟨hal-01909711⟩
  • A. Moncomble, D. Jani Thaviligadu, J.P. Cornard. Complexation of two divalent cations with a multisite flavonoid ligand. ISMEC 2017 - International Symposium on Metal Complexes, Jun 2017, Dijon, France. ⟨hal-01579484⟩
  • A. Moncomble, J.P. Cornard. Modeling natural compound models in soils: an application of quantum chemistry to better understand their interactions in the environment. CPC16 - Chemical Physics Conference, Oct 2016, Nancy, France. ⟨hal-01389461⟩
  • A. Moncomble, J.P. Cornard. Influence of a sequester ligand on the activity of a lone pair of PbII cation. ESCB1 - First European Symposium on Chemical Bonding, Sep 2016, Rouen, France. ⟨hal-01387976⟩
  • C. Falantin, A. Le Person, A. Moncomble, J.P. Cornard. Comparison of metal complexing properties of 3-hydroxyflavone and 3-hydroxyflavothione by molecular spectroscopy. International Conference on Polyphenols, Jul 2016, Vienne, Austria. ⟨hal-01387916⟩
  • A. Le Person, A. Moissette, M. Hureau, A. Kokaislova, A. Moncomble, et al.. Photoreactivity and metal complexation of 3-hydroxyflavone: highlighting of the confinement effect in zeolite by comparison with solution. International Conference on Polyphenols, Jul 2016, Vienne, Austria. ⟨hal-01387973⟩
  • A. Moncomble, J.P. Cornard. Toute la lumière sur la quercétine et ses complexes métalliques en solution. Journées SCF Centre-Ouest 2016, Mar 2016, Poitiers, France. ⟨hal-01297891⟩
  • A. Moncomble, J.P. Cornard, S. Boumendil, M. Sekkal-Rahal. Solvent effects to compute UV-vis spectra for ionic metal complexes. 16th International Conference on Density Functional Theory and its Applications, Sep 2015, Debrecen, Hungary. ⟨hal-01195938⟩
  • G. Deblonde, N. Delaunay, A. Moncomble, A. Chagnes, G. Cote. Speciation of niobium and tantalum in alkaline media. ACS National Meeting Fall, Aug 2015, Boston, United States. ⟨hal-01187179⟩
  • A. Moncomble, J.P. Cornard. Elucidation of metal complex structures by TD-DFT calculations coupled with electronic spectroscopies. TCSBS - Theory and Computation in Sciences and Bio-Sciences, Nov 2014, Tlemcen, Algeria. ⟨hal-01163783⟩
  • A. Moncomble, J.P. Cornard. Coexistence of several metal complexes involving a multisite ligand: evidences from TD-DFT and electronic spectroscopies investigations. 50th Symposium on Theoretical Chemistry, Sep 2014, Vienne, Austria. ⟨hal-01062971⟩
  • G. Deblonde, A. Chagnes, G. Cote, S. Belair, A. Moncomble, et al.. UV-vis and solid state MAS NMR as efficient techniques to investigate niobium and tantalum speciation in alkaline media. 6th International Conference of Hydrometallurgy, Aug 2014, Pékin, China. ⟨hal-01187175⟩
  • Thomas Guillon, A. Moncomble, A. Chagnes, G. Cote. Modèle physicochimique de la dégradation d'amines lors de l'extraction de l'uranium. 14ème Rencontre des Chimistes Théoriciens Francophones, Jul 2014, Paris, France. ⟨hal-01061796⟩
  • A. Moncomble, J.P. Cornard. Étude de complexes binucléaires d'aluminium par TD-DFT. 14ème Rencontre des Chimistes Théoriciens Francophones, Jul 2014, Paris, France. ⟨hal-01061789⟩
  • G. Deblonde, A. Chagnes, G. Cote, S. Belair, A. Moncomble. UV-visible properties of hexaniobate compounds. Frontiers in Metal Oxide Cluster Science 2014, Jul 2014, Maffliers, France. ⟨hal-01061800⟩
  • A. Moncomble. La densité électronique : utilisation directe en chimie quantique. Journées de Chimie X-ENS, May 2014, Palaiseau, France. ⟨hal-01062965⟩
  • A. Moncomble, J.P. Cornard. TD-DFT and electronic spectroscopy: a powerful combination for structural assignment. Illustration by the quercetin complexation. 10th International Conference of Computational Methods in Sciences and Engineering, Apr 2014, Athènes, Greece. ⟨hal-01061781⟩
  • A. Moncomble, J.P. Cornard, A. Le Person. Study of the interaction between metallic cations and protocatechuic acid isomers. TD-DFT Conference, Apr 2013, Nantes, France. ⟨hal-00830682⟩
  • S. Say-Liang-Fat, J.P. Cornard, A. Moncomble. Spectroscopic and theoretical studies of metal ions complexation by some model polyphenols of humis substances. Towards a better understanding of metal retention in soils. International Conference on Polyphenols, Jul 2012, Florence, Italy. ⟨hal-00740100⟩
  • G. Lewin, A. Maciuk, A. Moncomble, J.P. Cornard. Emergence of high aqueous solubility for some natural flavone glycosides by disruption of molecular planarity. International Congress on Natural Products Research, Jul 2012, New-York, United States. ⟨hal-00740104⟩
  • A. Moncomble, S. Say-Liang-Fat, J.P. Cornard. Études de l'interaction entre cations métalliques et composants modèles des sols. 13ème Rencontre des Chimistes Théoriciens Francophones, Jul 2012, Marseille, France. ⟨hal-00740096⟩
  • Aurélien Moncomble, Pascal Le Floch, Corinne Gosmini. Cobalt-catalyzed formation of symmetrical biaryls (affiche). Journées de chimie organique, Sep 2010, France. ⟨hal-00531459⟩
  • Aurélien Moncomble, Pascal Le Floch, Corinne Gosmini. Cobalt-Catalysed Vinylation of Aromatic Halides (affiche). Rencontres de chimie organique, Apr 2010, France. ⟨hal-00531456⟩
  • Aurélien Moncomble, Pascal Le Floch, Corinne Gosmini. Vinylation réductrice catalysée par le cobalt (affiche). Journées de chimie de coordination, Jan 2010, France. ⟨hal-00531454⟩
  • Aurélien Moncomble, Pascal Le Floch, Corinne Gosmini. Formation de biaryles symétriques par catalyse au cobalt. 7èmes Rencontres de Chimie Organique, Apr 2009, Paris, France. ⟨hal-00385144⟩
  • Aurélien Moncomble, Corinne Gosmini, Pascal Le Floch. Etude théorique et expérimentale de la formation de biaryles symétriques par catalyse au cobalt. Sajec 2008, Oct 2008, Batz-sur-mer, France. ⟨hal-00361755⟩
  • Corinne Gosmini, Muriel Amatore, Aurélien Moncomble. Formation de biaryles par catalyse au cobalt. GECO 2008, Aug 2008, Seillac, France. ⟨hal-00361747⟩
  • Corinne Gosmini, Muriel Amatore, Aurélien Moncomble, Pascal Le Floch. Formation de biaryles symétriques et disymétriques par catalyse au cobalt (affiche). GECOM CONCOORD 2008, May 2008, Dourdan, France. ⟨hal-00362551⟩
  • Aurélien Moncomble. SAJEC 2007 affiche. Etude théorique et expérimentale de la formation de biaryle catalysée par des complexes de cobalt, Oct 2007, La Brosse Montceaux, France. ⟨hal-00198666⟩
  • Aurélien Moncomble. Journées de Chimie Organique 2007 affiche. Etude théorique et expérimentale de la formation de biaryle catalysé par des complexes de cobalt, Sep 2007, Palaiseau, France. ⟨hal-00198592⟩

Poster

  • Luc Labarrière, yevheniia Smortsova, François Alexandre Miannay, Aurélien Moncomble, Jean-Paul Cornard. The triply fluorescent 2’,3-dihydroxyflavone computationally and spectroscopically investigated. International Conference on Photochemistry, Jul 2021, webconference, Switzerland. ⟨hal-03417449⟩
  • Aurélien Moncomble, Diksha Jani Thaviligadu, Jean-Paul Cornard. Theoretical and experimental studies on the complexation of fourth period divalent cations with flavonoids. European Symposium on Chemical Bonding 2, Sep 2018, Oviedo, Spain. ⟨hal-01909732⟩
  • Diksha Jani Thaviligadu, Aurélien Moncomble, Jean-Paul Cornard. Study of Mn(II)-flavonoids systems by spectroscopy and quantum chemistry calculations. 16th International Congress of Quantum Chemistry, Jun 2018, Menton, France. ⟨hal-01909731⟩
  • Aurélien Moncomble, Diksha Jani Thaviligadu, Jean-Paul Cornard. Étude théorique et expérimentale de la complexation du cation ZnII avec la morine. Journées "Théorie, Modélisation et Simulations" 2018, May 2018, Paris, France. ⟨hal-01909728⟩
  • Aurélien Moncomble, Cécilia Falantin, Annaïg Le Person, Jean-Paul Cornard. Effect of oxygen-by-sulfur exchange on desexcitation pathways in flavonols. Workshop for Young Researchers on Photo-active materials with Cooperative and Synergetic Responses, Mar 2018, Villeneuve d’Ascq, France. ⟨hal-01909725⟩
  • Diksha Jani Thaviligadu, Aurélien Moncomble, Jean-Paul Cornard. From the ground state to the excited states of polycyclic aromatic hydrocarbons with DFT and TD-DFT. Workshop for Young Researchers on Photo-active materials with Cooperative and Synergetic Responses 2018, Mar 2018, Villeneuve d’Ascq, France. ⟨hal-01909722⟩
  • Lucie Duplouy, Matthieu Hureau, Aurélien Moncomble, Alain Moissette, Vincent de Waele. Electron Transfer and Charge Delocalization in Host-guest Zeolitic Materials Probed by Femtosecond mid-IR Spectroscopy. GFZ Congress 2018, Mar 2018, Cabourg, France. ⟨hal-01912731⟩
  • A. Moncomble, D. Jani Thaviligadu, J.P. Cornard. Complexation of some divalent cations with morin: a spectroscopic and theoretical study. WATOC 2017 - 11th Triennial Congress of the World Association of Theoretical and Computational Chemistry, Sep 2017, Munich, Germany. ⟨hal-01586651⟩
  • D. Jani Thaviligadu, A. Moncomble, J.P. Cornard. The study of the complexation of manganese with morin: a theoretical and experimental approach. JNOEJC 2017 - Journée Nord Ouest Européenne des Jeunes Chercheurs, Jun 2017, Caen, France. ⟨hal-01580087⟩
  • C. Falantin, A. Le Person, A. Moncomble, J.P. Cornard. Influcence of oxygen-by-sulfur substitution on the complexation of environmental intesrest metals by model compounds of organic matter. ISMEC 2017 - International Symposium on Metal Complexes, Jun 2017, Dijon, France. ⟨hal-01580089⟩
  • A. Moissette, M. Hureau, A. Le Person, A. Kokaislova, J.P. Cornard, et al.. 3-hydroxyflavone sorption within channel-type zeolites: proton transfer and metal complexation. International Zeolite Conference, Jun 2016, Rio de Janeiro, Brazil. ⟨hal-01387323⟩
  • A. Le Person, A. Moissette, M. Hureau, A. Kokaislova, A. Moncomble, et al.. Effet du confinement sur la complexation métallique de Cu(II) et Zn(II) par la 3-hydroxyflavone adsorbée dans des zéolithes de type ZSM-5 et MOR. 32ème Réunion Annuelle du Groupe Français des Zéolithes, Mar 2016, Montpellier, France. ⟨hal-01389453⟩
  • A. Moncomble, C. Falantin, A. Le Person, J.P. Cornard. Complexation de la 3-hydroxyflavone avec le cation CuII : élucidation structurale en solution méthanolique. RCTF 2016, 2016, Lyon, France. ⟨hal-01348825⟩
  • A. Le Person, M. Siampiringue, M Sarakha, A. Moncomble, J.P. Cornard. The photo-degradation of mesotrione, a triketone herbicide, in the presence of CuII ions. 21st International Symposium on the Photochemistry and Photophysics of Coordination Compounds, Jul 2015, Cracovie, Poland. ⟨hal-01246221⟩
  • A. Moncomble, J.P. Cornard. TD-DFT and electronic spectroscopies investigations of quercetine complexation with two divalent cations. MPM - Modeling Photoactive Molecules, Apr 2015, Nantes, France. ⟨hal-01163793⟩
  • S. Boumendil, A. Moncomble, J.P. Cornard, M. Sekkal-Rahal. Influence of the used solvation model on the computation of electronic spectra of metal complexes: the example of Al(III)-caffeic acid system. TCSBS - Theory and Computation in Sciences and Bio-Sciences, Nov 2014, Tlemcen, Algeria. ⟨hal-01163789⟩

Thèse

  • Aurélien Moncomble, Corinne Gosmini. Étude théorique et expérimentale de la formation de quelques liaisons carbone-carbone par catalyse au cobalt à partir d'halogénures aromatiques. Catalyse. Ecole Polytechnique X, 2010. Français. ⟨pastel-00569164⟩