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05 40 00 63 59
Groupe de recherche
Spectroscopie Moléculaire
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Permanent
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Chercheur
Batiment
A12
Etage
4° Ouest
Publications
(). Chiral Cobaltabis(dicarbollide) Catalysts Prepared Using a Silica Helical Nanoplatform for the Enantioselective Photooxidation of Aromatic Secondary Alcohols. In Chemistry A European Journal (Vol. 31, Issue 37, p. e202501213). https://doi.org/10.1002/chem.202501213
(). Phenothiazine Dimer as Efficient and Recyclable p-Type Organic Positive Electrode Material for Anion-Ion and Dual-Ion Batteries. In Batteries and Supercaps. https://doi.org/10.1002/batt.202500403
(). Crystal Structure of Bis(1-butyl-1-methypyrrolidinium) Perthiodicarbonate Complex. In Molbank (Vol. 2024, Issue 3, p. M1849). https://doi.org/10.3390/M1849
(). Investigating the potential of pyrazine dioxide based-compounds as organic electrodes for batteries. In Dalton Transactions (Vol. 53, Issue 43, p. 17498-17517). https://doi.org/10.1039/d4dt01144a
(). Impact of the Microstructure on Electrochemical Performances of Dilithium Benzoquinone Dioximate as a Positive Material for a Li-Ion Battery. In ACS Applied Polymer Materials (Vol. 5, Issue 12, p. 9865-9875). https://doi.org/10.1021/acsapm.3c01618
(). Carbonyl-Based Redox-Active Compounds as Organic Electrodes for Batteries: Escape from Middle-High Redox Potentials and Further Improvement?. In Journal of Physical Chemistry A (Vol. 127, Issue 24, p. 5104-5119). https://doi.org/10.1021/acs.jpca.3c00478
(). Seeking for Optimal Excited States in Photoinduced Electron-Transfer Processes─The Case Study of Brooker’s Merocyanine. In Journal of Physical Chemistry A (Vol. 126, Issue 51, p. 9577-9593). https://doi.org/10.1021/acs.jpca.2c04269
(). Atomic Group Decomposition of Charge Transfer Excitation Global Indexes. In Journal of Physical Chemistry A (Vol. 126, Issue 36, p. 6314-6328). https://doi.org/10.1021/acs.jpca.2c04607
(). Breaking the Structure of Liquid Hydrogenated Alcohols Using Perfluorinated tert-Butanol: A Multitechnique Approach (Infrared, Raman, and X-ray Scattering) Analyzed by DFT and Molecular Dynamics Calculations. In Journal of Physical Chemistry B (Vol. 126, Issue 9, p. 1992-2004). https://doi.org/10.1021/acs.jpcb.1c10776
(). The structure of liquid perfluoro Tert-Butanol using Infrared, Raman and X-Ray scattering analyzed by quantum DFT calculations and molecular Dynamics. In Chemical Physics Letters (Vol. 779, p. 138844). https://doi.org/10.1016/j.cplett.2021.138844
(). Gaseous hetero dimers of perfluoro tert-butyl alcohol with hydrogenated alcohols by infrared spectroscopy and quantum DFT calculations. In Chemical Physics (Vol. 544, p. 111110). https://doi.org/10.1016/j.chemphys.2021.111110
(). A tool for deciphering the redox potential ranking of organic compounds: a case study of biomass-extracted quinones for sustainable energy. In Physical Chemistry Chemical Physics (Vol. 22, Issue 36, p. 20212-20226). https://doi.org/10.1039/d0cp02045a
(). DFT Study of the Reaction Mechanisms of Carbon Dioxide and its Isoelectronic Molecules CS2 and OCS Dissolved in Pyrrolidinium and Imidazolium Acetate Ionic Liquids. In Journal of Physical Chemistry B (Vol. 120, Issue 23, p. 5243-5254). https://doi.org/10.1021/acs.jpcb.6b03229
(). Solvation of AgTFSI in 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ionic liquid investigated by vibrational spectroscopy and DFT calculations. In Journal of Raman Spectroscopy (Vol. 47, Issue 4, p. 449-456). https://doi.org/10.1002/jrs.4835
(). A simple method for preparation of a novel hydrophobic ionic liquid with a per-fluoro-tert-butoxide anion. In New Journal of Chemistry (Vol. 41, Issue 1, p. 47-50). https://doi.org/10.1039/C6NJ02575G
(). Electrodeposition of copper thin films from 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide. In Journal of Applied Electrochemistry (Vol. 45, Issue 1, p. 87-93). https://doi.org/10.1007/s10800-014-0773-0
(). Understanding chemical reactions of CO2 and its isoelectronic molecules with 1-butyl-3-methylimidazolium acetate by changing the nature of the cation: The case of CS2 in 1-butyl-1-methylpyrrolidinium acetate studied by NMR spectroscopy and density functional theory calculations. In Journal of Chemical Physics (Vol. 140, Issue 24, p. 244307). https://doi.org/10.1063/1.4884820
(). Electrodeposition of nanocrystalline copper thin films from 1-ethyl-3-methylimidazolium ethylsulphate ionic liquid. In Journal of Applied Electrochemistry (Vol. 44, Issue 1, p. 189-198). https://doi.org/10.1007/s10800-013-0630-6
(). Experimental and theoretical studies of tetramethoxy-p-benzoquinone: Infrared spectra, structural and lithium insertion properties. In Rsc Advances (Vol. 3, Issue 41, p. 19081-19096). https://doi.org/10.1039/c3ra41974f
(). On the chemical reactions of carbon dioxide isoelectronic molecules CS2 and OCS with 1-butyl-3-methylimidazolium acetate. In Chemical Communications (Vol. 49, Issue 94, p. 11083-11085). https://doi.org/10.1039/c3cc46038j
(). Assessing the non-ideality of the CO2-CS2 system at molecular level: A Raman scattering study. In Journal of Chemical Physics (Vol. 139, Issue 12, p. 124504). https://doi.org/10.1063/1.4821593
(). Why is the CO2-CS2 non-ideality larger than in CO2-CCl4? A Raman scattering study. In Chemical Physics Letters (Vol. 583, p. 49-53). https://doi.org/10.1016/j.cplett.2013.07.061
(). CO 2 in 1-butyl-3-methylimidazolium acetate. 2. NMR investigation of chemical reactions. In Journal of Physical Chemistry A (Vol. 116, Issue 20, p. 4890-4901). https://doi.org/10.1021/jp211689z
(). Carbon dioxide in 1-butyl-3-methylimidazolium acetate. I. Unusual solubility investigated by Raman spectroscopy and DFT calculations. In Journal of Physical Chemistry A (Vol. 116, Issue 6, p. 1605-1620). https://doi.org/10.1021/jp211211n
(). On the spontaneous carboxylation of 1-butyl-3-methylimidazolium acetate by carbon dioxide. In Chemical Communications (Vol. 48, Issue 9, p. 1245-1247). https://doi.org/10.1039/c1cc16702b
(). Solubility of CO2 in 1-butyl-3-methyl-imidazolium-trifluoro acetate ionic liquid studied by Raman spectroscopy and DFT investigations. In Journal of Physical Chemistry B (Vol. 115, Issue 13, p. 3538-3550). https://doi.org/10.1021/jp111453a
(). Local structure in ionic liquids investigated by hyper-Rayleigh scattering. In Journal of Physical Chemistry B (Vol. 114, Issue 46, p. 15057-15065). https://doi.org/10.1021/jp107165k
(). Imidazolium-based ionic liquids: Quantitative aspects in the far-infrared region. In Journal of Physical Chemistry B (Vol. 114, Issue 22, p. 7587-7592). https://doi.org/10.1021/jp102087m
(). Interaction of water diluted in 1-butyl-3-methyl imidazolium ionic liquids by vibrational spectroscopy modeling. In Journal of Molecular Liquids (Vol. 153, Issue 1, p. 57-66). https://doi.org/10.1016/j.molliq.2009.07.001
(). Evolution with the density of CO2 clustering studied by Raman spectroscopy. In Journal of Molecular Liquids (Vol. 153, Issue 1, p. 15-19). https://doi.org/10.1016/j.molliq.2009.09.007
(). Interaction of water highly diluted in l-Alkyl-3-methyl imidazolium ionic liquids with the PF 6 - and BF 4 - anions. In Journal of Physical Chemistry A (Vol. 113, Issue 12, p. 2873-2889). https://doi.org/10.1021/jp8108368
(). Transient complex formation in CO2-hexafluorobenzene mixtures: A combined Raman and ab initio investigation. In Journal of Physical Chemistry A (Vol. 113, Issue 1, p. 184-192). https://doi.org/10.1021/jp8068267
(). Raman spectroscopy and ab initio investigations of transient complex formation in CO2-benzene mixtures. In Journal of Chemical Physics (Vol. 129, Issue 22, p. 224511). https://doi.org/10.1063/1.3037025
(). Far infrared absorption and terahertz time domain spectroscopy of liquid C S2: Experiments and molecular dynamics simulation. In Applied Physics Letters (Vol. 92, Issue 21, p. 214102). https://doi.org/10.1063/1.2936935
(). Transient dimer formation in supercritical carbon dioxide as seen from Raman scattering. In Journal of Chemical Physics (Vol. 128, Issue 7, p. 074507). https://doi.org/10.1063/1.2833493
(). Raman investigation of the CO2 complex formation in CO 2-acetone mixtures. In Journal of Physical Chemistry A (Vol. 111, Issue 51, p. 13371-13379). https://doi.org/10.1021/jp0756653
(). Local density enhancement in supercritical carbon dioxide studied by Raman spectroscopy. In Journal of Physical Chemistry A (Vol. 111, Issue 50, p. 12966-12971). https://doi.org/10.1021/jp0756707
(). Hydrogen bonding in liquid and supercritical 1-octanol and 2-octanol assessed by near and midinfrared spectroscopy. In Journal of Chemical Physics (Vol. 125, Issue 9, p. 094503). https://doi.org/10.1063/1.2336424
(). Density Functional Theory (DFT) calculations of the infrared absorption spectra of acetaminophen complexes formed with ethanol and acetone species. In Journal of Physical Chemistry A (Vol. 110, Issue 28, p. 8986-9001). https://doi.org/10.1021/jp061845l
(). Bringing together fundamental and applied science: The supercritical fluids route. In Journal of Molecular Liquids (Vol. 125, Issue 2-3, p. 88-99). https://doi.org/10.1016/j.molliq.2005.05.010
(). Vibrational and rotational relaxation of hexafluorobenzene studied by Raman scattering in the supercritical domain. In Journal of Molecular Liquids (Vol. 125, Issue 2-3, p. 100-106). https://doi.org/10.1016/j.molliq.2005.11.002
(). Solute-solvent interactions governing preferential solvation phenomena of acetaminophen in CO2-expanded organic solutions. A spectroscopic and theoretical study. In Journal of Supercritical Fluids (Vol. 38, Issue 3, p. 295-305). https://doi.org/10.1016/j.supflu.2005.11.006
(). Water-carbon dioxide mixtures at high temperatures and pressures: Local order in the water rich phase investigated by vibrational spectroscopy. In Journal of Chemical Physics (Vol. 123, Issue 22, p. 224501). https://doi.org/10.1063/1.2131052
(). Raman spectroscopy of CO2-acetone and CO2-ethanol complexes. In Chemical Physics Letters (Vol. 413, Issue 4-6, p. 258-262). https://doi.org/10.1016/j.cplett.2005.07.091
(). Structural evolution of aqueous NaCl solutions dissolved in supercritical carbon dioxide under isobaric heating by mid and near infrared spectroscopy. In Journal of Chemical Physics (Vol. 122, Issue 9, p. 094505). https://doi.org/10.1063/1.1858440
(). Ab initio investigation of vibrational spectra of water-(CO 2)n complexes (n = 1, 2). In Journal of Physical Chemistry A (Vol. 109, Issue 14, p. 3250-3256). https://doi.org/10.1021/jp0503819
(). Dynamic of solitary water in hydrophobic solvents. In Journal of Molecular Liquids (Vol. 117, Issue 1-3, p. 49-61). https://doi.org/10.1016/j.molliq.2004.08.030
(). Water-CO 2 interaction in supercritical CO 2 as studied by infrared spectroscopy and vibrational frequency shift calculations. In Journal of Supercritical Fluids (Vol. 33, Issue 1, p. 85-92). https://doi.org/10.1016/j.supflu.2004.05.003
(). Synergistic enhancement of the solubility of hexamethylenetetramine in subcritical CO2-ethanol mixtures studied by infrared spectroscopy. In Chemphyschem (Vol. 6, Issue 4, p. 587-590). https://doi.org/10.1002/cphc.200400499
(). Infrared and molecular-dynamics studies of the rotational dynamics of water highly diluted in supercritical CO2. In Journal of Chemical Physics (Vol. 123, Issue 7, p. 074505). https://doi.org/10.1063/1.1953561
(). A vibrational spectroscopic study of structure evolution of water dissolved in supercritical carbon dioxide under isobaric heating. In Journal of Chemical Physics (Vol. 120, Issue 22, p. 10691-10698). https://doi.org/10.1063/1.1739214
(). Hydrogen bonding in supercritical ethanol assessed by infrared and raman spectroscopies. In Journal of Physical Chemistry A (Vol. 108, Issue 18, p. 3902-3909). https://doi.org/10.1021/jp0309466
(). CO 2-Ethanol Interaction Studied by Vibrational Spectroscopy in Supercritical CO 2. In Journal of Physical Chemistry A (Vol. 108, Issue 14, p. 2617-2624). https://doi.org/10.1021/jp037802b
(). Molecular insight, through IR spectroscopy, on solvating phenomena occurring in CO2-expanded solutions. In Chemphyschem (Vol. 5, Issue 2, p. 243-245). https://doi.org/10.1002/cphc.200300921
(). Local density inhomogenities detected by Raman scattering in supercritical hexafluorobenzene. In Pure and Applied Chemistry (Vol. 76, Issue 1, p. 141-146). https://doi.org/10.1351/pac200476010141
(). Supercritical water: Local order and molecular dynamics. In Pure and Applied Chemistry (Vol. 76, Issue 1, p. 133-139). https://doi.org/10.1351/pac200476010133
(). Vibrational spectra of CO2-electron donor-acceptor complexes from ab initio. In Journal of Physical Chemistry A (Vol. 106, Issue 48, p. 11831-11840). https://doi.org/10.1021/jp021598v
(). Infrared spectroscopic study of hydrogen-bonding in water at high temperature and pressure. In Journal of Molecular Liquids (Vol. 101, Issue 1-3, p. 149-158). https://doi.org/10.1016/S0167-7322(02)00089-2
(). Raman and infrared studies of hydrogen-bonding in supercritical ethanol. In Journal of Molecular Liquids (Vol. 98-99, p. 203-214). https://doi.org/10.1016/s0167-7322(01)00317-8
(). A structural study of the hexafluorobenzene from liquid to supercritical conditions using neutron diffraction and molecular dynamics. In Journal of Chemical Physics (Vol. 115, Issue 9, p. 4239-4248). https://doi.org/10.1063/1.1389292
(). Evolution of the local order in 1, 3, 5-trifluorobenzene from the liquid state up to supercritical conditions. In Journal of Physical Chemistry A (Vol. 104, Issue 46, p. 10986-10993). https://doi.org/10.1021/jp002612b
(). Molecular dynamics of monomeric water dissolved in very hydrophobie solvents: The current state of the art of vibrational spectroscopy analyzed from analytical model and MD simulations. In Journal of Physical Chemistry A (Vol. 104, Issue 42, p. 9415-9427). https://doi.org/10.1021/jp001091p
(). The structure of liquid and supercritical benzene as studied by neutron diffraction and molecular dynamics. In Journal of Chemical Physics (Vol. 113, Issue 9, p. 3757-3765). https://doi.org/10.1063/1.1287787
(). Structural study of the 1-3-5 trifluorobenzene dimer stability: From liquid to gas densities using supercritical conditions. In Chemical Physics Letters (Vol. 325, Issue 1-3, p. 163-170). https://doi.org/10.1016/S0009-2614(00)00607-2
(). On the nature of the water-hexafluorobenzene interaction. In Journal of Physical Chemistry A (Vol. 103, Issue 18, p. 3530-3534). https://doi.org/10.1021/jp984726h
(). Structural investigations of liquid binary mixtures: neutron diffraction and molecular dynamics studies of benzene, hexafluorobenzene, and 1,3,5-trifluorobenzene. In Journal of Physical Chemistry B (Vol. 102, Issue 52, p. 10712-10723). https://doi.org/10.1021/jp982880y
(). Neutron diffraction and molecular dynamics study of liquid benzene and its fluorinated derivatives as a function of temperature. In Journal of Physical Chemistry B (Vol. 101, Issue 35, p. 6977-6987). https://doi.org/10.1021/jp971331+
(). Neutron diffraction and molecular dynamics investigations of the temperature dependence of the local ordering in liquid cyclopropane. In Molecular Physics (Vol. 90, Issue 5, p. 817-828). https://doi.org/10.1080/002689797172165
(). Structural studies of liquid cyclopropane: From room temperature up to supercritical conditions. In Molecular Physics (Vol. 90, Issue 5, p. 829-840). https://doi.org/10.1080/002689797172174
(). Evidence of dimer formation in neat liquid 1,3,5-trifluorobenzene. In Chemical Physics Letters (Vol. 262, Issue 1-2, p. 120-124). https://doi.org/10.1016/0009-2614(96)01049-4
(). Spectroscopic studies of vibrational relaxation and chemical exchange broadening in hydrogen bonded systems. IV. Analysis of the isotropic raman bands of pyridine/water system. In Molecular Physics (Vol. 85, Issue 2, p. 385-393). https://doi.org/10.1080/00268979500101171
(). Spectroscopic studies of vibrational relaxation and chemical exchange broadening in hydrogen-bonded systems. III. Equilibrium processes in the pyridine/water system. In Molecular Physics (Vol. 85, Issue 2, p. 373-383). https://doi.org/10.1080/00268979500101161
(). Vibrational spectroscopic studies on the state of aggregation of water in carbon tetrachloride, in dioxane and in the mixed solvents. In Journal of Molecular Liquids (Vol. 64, Issue 1-2, p. 197-210). https://doi.org/10.1016/0167-7322(95)00816-S
(). A far infrared study of water diluted in hydrophobic solvents. In Molecular Physics (Vol. 84, Issue 4, p. 769-785). https://doi.org/10.1080/00268979500100531
(). A far infrared study of benzene-fluorinated benzene binary mixtures. In Chemical Physics (Vol. 184, Issue 1-3, p. 225-231). https://doi.org/10.1016/0301-0104(94)00106-5
(). Investigation of charge-transfer complexes by computer simulation. II. Iodine in pyridine solution. In Journal of Chemical Physics (Vol. 96, Issue 5, p. 3795-3810). https://doi.org/10.1063/1.462841
(). Investigation of charge-transfer complexes by computer simulation. I. Iodine in benzene solution. In Journal of Chemical Physics (Vol. 96, Issue 5, p. 3782-3794). https://doi.org/10.1063/1.461884