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Nicolas Sieffert
Lecturer (Maître de Conférences) Université Joseph Fourier Grenoble. France. |
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FULL PAPERS 21 -
Bühl,
M.; Sieffert, N.;
Chaumont, A.; Wipff, G.
" Water versus Acetonitrile Coordination to Uranyl. Effect of Chloride Ligands." Inorg. Chem.; (Article); 2012 ; in press 20 - Bühl, M.; Sieffert, N.; Chaumont, A.; Wipff, G. " Water versus Acetonitrile Coordination to Uranyl. Density Functional Study of Cooperative Polarization Effects in Solution." Inorg. Chem.; (Article); 2011 ; 50, 299-308 http://pubs.acs.org/doi/abs/10.1021/ic101950d 19 – Waddell, P. G. ; Slawin, A. M. Z. ; Sieffert, N. ; Bühl, M. ; Woollins, J. D. " The Preparation and Structure of [Pt(S2N2){P(OR)nR′3–n}2] and [Pt(SeSN2){P(OMe)nPh3–n}2] (n = 0–3) " Eur. J. Inorg. Chem.; (Article); 2010 ; 20 ; 3185-3194. http://onlinelibrary.wiley.com/doi/10.1002/ejic.201000329/abstract 18 - Sieffert, N.; Bühl, M. " Hydrogen Generation from Alcohols Catalyzed by Ruthenium-Triphenylphosphine Complexes: Multiple Reaction Pathways. " J. Am. Chem. Soc.; (Article); 2010 ; 132 ; 8058-8070. http://pubs.acs.org/doi/abs/10.1021/ja101044c 17 - Bühl, M.; Schreckenbach, G.; Sieffert, N.; Wipff, G. " Effect of Counterions on Structure and Stability of Aqueous Uranyl(VI) Complexes. A First-Principles Molecular Dynamics Study." Inorg. Chem.; (Commun.); 2009 ; 48 ; 9977-9979. http://pubs.acs.org/doi/abs/10.1021/ic901298q 16 - Sieffert, N.; Chaumont, A.; Wipff, G. " Importance of the Liquid-Liquid Interface in Assisted Ion Extraction: new Molecular Dynamics Studies of Cesium Picrate Extraction by a Calix[4]arene ." J. Phys. Chem. C.; (Article); 2009 ; 113 (24) ; 10610–10622 http://pubs.acs.org/doi/abs/10.1021/jp900789v 15 - Sieffert, N.; Bühl, M. " Noncovalent Interactions in a Transition-Metal Triphenylphosphine Complex: a Density Functional Case Study. " Inorg. Chem.; (Commun.); 2009 ; 48 ; 4622-4624. http://pubs.acs.org/doi/abs/10.1021/ic900347e 14 - Bühl, M.; Sieffert, N.; Wipff, G. " Density Functional Study of Aqueous Uranyl(VI) Fluoride Complexes. " Chem. Phys. Lett.; (Letter); 2009 ; 467 (4-6) ; 287-293 http://dx.doi.org/10.1016/j.cplett.2008.11.015 13 - Sieffert, N.; Wipff, G. " Ordering of Imidazolium-Based Ionic Liquids at the α-Quartz(001) Surface: A Molecular Dynamics Study. " J. Phys. Chem. C.; (Article); 2008 ; 112 (49), 19590–19603 http://pubs.acs.org/doi/abs/10.1021/jp806882e 12 - Sieffert, N.; Wipff, G. " On the Importance of the Aqueous Interface in the Multiphasic Rhodium Catalyzed Hydroformylation of Propene: a Molecular Dynamics Study. " J. Phys. Chem. C.; (Article); 2008 ; 112 (38), 14891–14901 http://pubs.acs.org/doi/abs/10.1021/jp803546e 11 - Sieffert, N.; Wipff, G. " Adsorption at the Liquid-Liquid Interface in the Biphasic Rhodium Catalyzed Hydroformylation of 1-Hexene in Ionic Liquids : a Molecular Dynamics Study. " J. Phys. Chem. C.; (Article); 2008 ; 112(16) ; http://pubs.acs.org/cgi-bin/abstract.cgi/jpccck/2008/112/i16/abs/jp800150k.html 10 – Bühl, M.; Sieffert, N.; Golubnychiy, V.; Wipff, G. “ A Density Functional Theory Study of Uranium(VI) Aquo Chloro Complexes in Aqueous Solution.“ J. Phys. Chem. A.; (Article); 2008 ; 112(11) ; 2428-2436 http://pubs.acs.org/cgi-bin/abstract.cgi/jpcafh/2008/112/i11/abs/jp710093w.html 9 - Sieffert, N.; Wipff, G. “The Effect of a Solvent Modifier in the Cesium Extraction by a Calix[4]arene: A Molecular Dynamics Study of the Oil Phase and the Oil – Water Interface.” Phys. Chem. Chem. Phys. (Article); 2007 ; 9(28) ; 3763-3775 * http://www.rsc.org/Publishing/Journals/CP/article.asp?doi=b704395c * Highlighted in “Chemical Technology” Issue 7. July 2007 * Inside cover of PCCP (Issue 28). 8 - Sieffert, N.; Wipff, G. “ Solvation of Sodium Chloride in the [BMI][Tf2N] Ionic Liquid: A Molecular Dynamics Study. ” J. Phys. Chem. B.; (Article); 2007 ; 111(25) ; 7253-7266. http://pubs.acs.org/cgi-bin/abstract.cgi/jpcbfk/2007/111/i25/abs/jp071347s.html 7 - Sieffert, N.; Wipff, G. “ Rhodium Catalyzed Hydroformylation of 1-Hexene in an Ionic Liquid: A Molecular Dynamics Study of the Hexene – [BMI][PF6] Interface. ” J. Phys. Chem. B.; (Article); 2007 ; 111(18) ; 4951-4962 * http://pubs.acs.org/cgi-bin/abstract.cgi/jpcbfk/2007/111/i18/abs/jp0677952.html * Part of the special issue "Physical Chemistry of Ionic Liquids". 6 - Varnek, A. ; Fourches, D. ; Sieffert, N. ; Solov’ev V. P. ; Hill, C. ; Lecomte M. “ QSPR Modelling of the AmIII/EuIII Separation Factor : How Far Can we Predict ? ” Solv. Extr. Ion Exch. ; (Article); 2007 ; 25(1) ; 1-26. http://www.informaworld.com/smpp/content~content=a770469393~db=all~order=page 5 - Sieffert, N.; Wipff, G. “ Importance of Interfacial Adsorption in the Biphasic Hydroformylation of Higher Olefins Promoted by Cyclodextrins: A Molecular Dynamics Study at the Decene – Water Interface. ” Chem.– Eur. J. ; (Article); 2007; 13; 1978-1990. http://www3.interscience.wiley.com/cgi-bin/abstract/113494184/ABSTRACT 4 - Sieffert, N.; Wipff, G. “ Comparing an Ionic Liquid to a Molecular Solvent in the Cesium Cation Extraction by a Calixarene: A Molecular Dynamics Study of the Aqueous Interfaces. ” J. Phys. Chem. B.; (Article); 2006; 110(39); 19497-19506. http://pubs.acs.org/cgi-bin/abstract.cgi/jpcbfk/2006/110/i39/abs/jp063045g.html 3 - Sieffert, N.; Wipff, G. “ The [BMI][Tf2N] Ionic Liquid/Water Binary System: A Molecular Dynamics Study of Phase Separation and of the Liquid-Liquid Interface. ” J. Phys. Chem. B.; (Article); 2006; 110(26); 13076-13085. http://pubs.acs.org/cgi-bin/abstract.cgi/jpcbfk/2006/110/i26/abs/jp061849q.html 2 - Sieffert, N.; Wipff, G. “ Adsorption at the Liquid-Liquid Interface in the Biphasic Rhodium Catalyzed Hydroformylation of Olefins Promoted by Cyclodextrins: A Molecular Dynamics Study. ” J. Phys. Chem. B.; (Article); 2006; 110(9); 4125-4134. http://pubs.acs.org/cgi-bin/abstract.cgi/jpcbfk/2006/110/i09/abs/jp057023q.html 1 - Sieffert, N.; Wipff, G. “ Alkali Cation Extraction by Calix[4]crown-6 to Room-Temperature Ionic Liquids. The Effect of Solvent Anion and Humidity Investigated by Molecular Dynamics Simulations. ” J. Phys. Chem. A.; (Article); 2006; 110(3); 1106-1117. http://pubs.acs.org/cgi-bin/abstract.cgi/jpcafh/2006/110/i03/abs/jp054990s.html |