Publications

054 Advanced mono- and multi-dimensional gas chromatography–mass spectrometry techniques for oxygen-containing compound characterization in biomass and biofuel samples – Marco Beccaria, Anna Luiza Mendes Siqueira, Adrien Maniquet, Pierre Giusti, Marco Piparo, Pierre‐Hugues Stefanuto, Jean‐François FocantJournal of Separation Sciences, 2021, 44 (1), pp.115-134, DOI: 10.1002/jssc.202000907

053 Cyclic Ion Mobility Spectrometry Coupled to High-Resolution Time-of-Flight Mass Spectrometry Equipped with Atmospheric Solid Analysis Probe for the Molecular Characterization of Combustion Particulate Matter – Christopher P. Rüger, Johann Le Maître, Eleanor Riches, Martin Palmer, Jürgen Orasche, Olli Sippula, Jorma Jokiniemi, Carlos Afonso, Pierre Giusti, Ralf ZimmermannJASMS, 2021, 32 (1), pp.206-217, DOI: 10.1021/jasms.0c00274

052 Aggregation of petroporphyrins and fragmentation of porphyrin ions: Characterized by TIMS-TOF MS and FT-ICR MS – Fang Zheng, Yanfen Zhang, Yahe Zhang, Yehua Han, Linzhou Zhang, Brice Bouyssiere, Quan ShiFuel, 2021, 289, pp.119889, DOI: 10.1016/j.fuel.2020.119889

051 Compositional trends for total vanadium content and vanadyl porphyrins in gel permeation chromatography fractions reveal correlations between asphaltene aggregation and ion production efficiency in atmospheric pressure photoionization – Martha L. Chacón-Patiño, Rémi Moulian, Caroline Barrère-Mangote, Jonathan C. Putman, Chad R. Weisbrod, Greg T. Blakney, Brice Bouyssiere, Ryan P. Rodgers, Pierre GiustiEnergy & Fuels, 2020, 34 (12), pp.16158-16172, DOI: 10.1021/acs.energyfuels.0c03349

050 Molecular Cartography of A1 and A2 Asphaltene Subfractions from Classical Molecular Dynamics Simulations – Orlando Villegas, Germain Salvato Vallverdu, Brice Bouyssiere, Sócrates Acevedo, Jimmy Castillo, Isabelle BarailleEnergy & Fuels, 2020, 34 (11), pp.13954-13965, DOI: 10.1021/acs.energyfuels.0c02744

049 Methods for Total and Speciation Analysis of Mercury in the Petroleum Industry – Maxime Enrico, Aurore Mere, Honggang Zhou, Matthieu Loriau, Emmanuel Tessier, Brice BouyssiereEnergy & Fuels, 2020, 34 (11), pp.13307-13320, DOI: 10.1021/acs.energyfuels.0c02730

048 Understanding the Vanadium–Asphaltene Nanoaggregate Link with Silver Triflate Complexation and GPC ICP-MS Analysis – Remi Moulian, Fang Zheng, Germain Salvato Vallverdu, Caroline Barrere-Mangote, Quan Shi, Pierre Giusti, Brice BouyssiereEnergy & Fuels, 2020, 34 (11), pp.13759-13766, DOI: 10.1021/acs.energyfuels.0c02505

047 Understanding Asphaltene Fraction Behavior through Combined Quartz Crystal Resonator Sensor, FT-ICR MS, GPC ICP HR-MS, and AFM Characterization. Part I: Extrography Fractionations – Nelson Acevedo, Remi Moulian, Martha L. Chacón-Patiño, Aurora Mejia, Sadia Radji, Jean-Luc Daridon, Caroline Barrère-Mangote, Pierre Giusti, Ryan P. Rodgers, Vincent Piscitelli, Jimmy Castillo, Hervé Carrier, Brice BouyssiereEnergy & Fuels, 2020, 34 (11), pp.13903-13915, DOI: 10.1021/acs.energyfuels.0c02687

046 Fractionation and Characterization of Petroleum Asphaltene: Focus on Metalopetroleomics – Fang Zheng, Quan Shi, Germain Salvato Vallverdu, Pierre Giusti, Brice BouyssiereProcesses, 2020, 8 (11), pp.1504, DOI: 10.3390/pr8111504

045 Chemical Characterization Using Different Analytical Techniques to Understand Processes: The Case of the Paraffinic Base Oil Production Line – Rémi Moulian, Johann Le Maître, Hélène Leroy, Ryan Rodgers, Brice Bouyssiere, Carlos Afonso, Pierre Giusti, Caroline Barrère-MangoteProcesses, 2020, 8 (11), pp.1472, DOI: 10.3390/pr8111472

044 Characterization of Polyethylene Branching by Thermal Analysis-Photoionization Mass Spectrometry – Christoph Grimmer, Lukas Friederici, Thorsten Streibel, Ahmad Naim, Virginie Cirriez, Pierre Giusti, Carlos Afonso, Christopher P. Rüger, Ralf ZimmermannJASMS, 2020, 31 (11), pp.2362–2369, DOI: 10.1021/jasms.0c00291

043 Speciation of Metals in Asphaltenes by High-Performance Thin-Layer Chromatography and Solid–Liquid Extraction Hyphenated with Elemental and Molecular Identification – Rémi Moulian, Martha Chacón-Patiño, Oscar Lacroix-Andrivet, Sandra Mounicou, Anna Luiza Mendes-Siqueira, Carlos Afonso, Ryan Rodgers, Pierre Giusti, Brice Bouyssiere, Caroline Barrère-MangoteEnergy and Fuels, 2020, 34 (10), pp.12449–12456, DOI: 10.1021/acs.energyfuels.0c02525

042 Careful Investigations of PTV Injection Parameters for the Analysis of Vacuum Gas Oil by High-Temperature Comprehensive GC×GC – Marco Piparo, Lucille Flamant, Gaelle Jousset, Pascal Cardinael, Pierre GiustiEnergy and Fuels, 2020, 34 (10), pp.12010–12017, DOI: 10.1021/acs.energyfuels.0c01314

041 Comparison of Silica and Cellulose Stationary Phases to Analyze Bitumen by High-Performance Thin-Layer Chromatography Coupled to Laser Desorption Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry – Oscar Lacroix-Andrivet, Marie Hubert-Roux, Anna Luiza Mendes-Siqueira, Yang Bai, Carlos AfonsoEnergy and Fuels, 2020, 34 (8), pp.9296–9303, DOI: 10.1021/acs.energyfuels.0c00709

040 Structural Analysis of Neutral Nitrogen Compounds Refractory to the Hydrodenitrogenation Process of Heavy Oil Fractions by High-Resolution Tandem Mass Spectrometry and Ion Mobility–Mass Spectrometry – Johann Le Maître, Benoit Paupy, Marie Hubert-Roux, Sabrina Marceau, Christopher Rüger, Carlos Afonso, Pierre GiustiEnergy and Fuels, 2020, 34 (8), pp.9328–9338, DOI: 10.1021/acs.energyfuels.0c01160

039 Probing Aggregation Tendencies in Asphaltenes by Gel Permeation Chromatography. Part 2: Online Detection by Fourier Transform Ion Cyclotron Resonance Mass Spectrometry and Inductively Coupled Plasma Mass Spectrometry – Jonathan C. Putman, Rémi Moulian, Donald F. Smith, Chad R. Weisbrod, Martha L. Chacón-Patiño, Yuri E. Corilo, Greg T. Blakney, Leah E. Rumancik, Caroline Barrère-Mangote, Ryan P. Rodgers, Pierre Giusti, Alan G. Marshall, Brice BouyssiereEnergy and Fuels, 2020, 34 (9), pp.10915–10925, DOI: 10.1021/acs.energyfuels.0c02158

038 Probing Aggregation Tendencies in Asphaltenes by Gel Permeation Chromatography. Part 1: Online Inductively Coupled Plasma Mass Spectrometry and Offline Fourier Transform Ion Cyclotron Resonance Mass Spectrometry – Jonathan C. Putman, Rémi Moulian, Caroline Barrère-Mangote, Ryan P. Rodgers, Brice Bouyssiere, Pierre Giusti, Alan G. MarshallEnergy and Fuels, 2020, 34 (7), pp.8308–8315, DOI: 10.1021/acs.energyfuels.0c01522

037 Mass Spectrometry-Based Analytical Strategy for Comprehensive Molecular Characterization of Biodegradable Poly(lactic-co-glycolic Acid) Copolymers – Thierry N. J. Fouquet, Hélène Pizzala, Marion Rollet, Delphine Crozet, Pierre Giusti, Laurence Charles JASMS, 2020, 31 (7), pp.1554–1562, DOI: 10.1021/jasms.0c00137

036 Paraffin-Inert Atmospheric Solid Analysis Probe: A Fast and Easy Approach to Characterize Extremely Air-Sensitive Organometallic Complexes by Mass Spectrometry – Ahmad Naim, Mathilde Farenc, M. Hubert-Roux, T. Chavagnan, V. Cirriez, A. Welle, A. Vantomme, Evgueni Kirillov, Jean-François Carpentier, Carlos Afonso, Pierre Giusti Analytical Chemistry, 2020, 92 (4), pp.2922–2925, DOI: 10.1021/acs.analchem.9b04478

035 Quantitative multiplexed elemental (C, H, N and S) detection in complex mixtures using gas chromatography – Laura Freije-Carrelo, Javier García-Bellido, L. Alonso Sobrado, Mariella Moldovan, B. Bouyssiere, Pierre Giusti, Jorge Ruiz-Encinar – Chemical Communications, 2020, 56 (19), pp.2905-2908, DOI: 10.1039/c9cc09842a

034 Redox activity of nickel and vanadium porphyrins: a possible mechanism behind petroleum genesis and maturation – G. Munoz , Gunessee B.K., Bégué D., B. Bouyssiere, I. Baraille, G. Vallverdu, H. Santos Silva – RSC Advances, 2019, 17, pp.9509-9516, DOI: 10.1039/C9RA01104H

033 Asphaltene aggregation studied by molecular dynamics simulations: role of the molecular architecture and solvents on the supramolecular or colloidal behavior – H. Santos Silva, Alfarra A., Vallverdu G., Bégué D., B. Bouyssiere, I. Baraille – Petroleum Science, 2019, 16 (3), pp.669-684, DOI: 10.1007/s12182-019-0321-y

032 Future challenges and new approaches: General discussion – C. Afonso, Chaux C., Davies A.N., Delsuc M.-A., Fernandez Lima F., Gauchotte-Lindsay C., Giusti P., Goodacre R., Hawkes J.A., Hertkorn N., Jansen J.J., Kew W., Kuhn S., Lubben A., McGill D., Nilsson M., Parkinson J., Rodgers R.P., Rogers S., Schmitt-Kopplin P., Schoenmakers P.J., Shintu L., Soong R., Summerfield S., Surman A., Uhrín D., Van Der Hooft J.J.J. – Faraday Discussions, 2019, 218, pp.505-523, DOI: 10.1039/C9FD90046B-y

031 Data mining and visualisation: General discussion – C. Afonso, M.P. Barrow, Davies A.N., Delsuc M.-A., Ebbels T., Fernandez-Lima F., Gauchotte-Lindsay C., Giusti P., Goodacre R., Hertkorn N., Jansen J.J., Jones D., Kew W., Kuhn S., Le Guennec A., Lubben A., Parkinson J., Paša-Tolić L., Rogers S., Rudd T.R., Schoenmakers P.J., Sidebottom P., Summerfield S., Tinnevelt G.H., Trifirò G., Trygg J., Van Der Hooft J.J.J. – Faraday Discussions, 2019, 218, pp.354-371, DOI: 10.1039/C9FD90044F-y

030 Dealing with complexity: General discussion – C. Afonso, M.P. Barrow, N.G.A. Bell, A.N. Davies, D. Duca, C. Focsa, C. Gauchotte-Lindsay, P. Giusti, R. Godfrey, R. Goodacre, J.A. Hawkes, N. Hertkorn, J.J. Jansen, D. Jones, W. Kew, A. Le Guennec, A. Lubben, L. Paša-Tolić, R.P. Rodgers,C.P. Rüger, P. Schmitt-Kopplin, P.J. Schoenmakers, D. Sciarrone, S. Summerfield, D. Uhrín, F.H.M. Van Zelst – Faraday Discussions, 2019, 218, pp.138-156, DOI: 10.1039/C9FD90055A

029 Structural analysis of heavy oil fractions after hydrodenitrogenation by high-resolution tandem mass spectrometry and ion mobility spectrometry – J. Le Maître, M. Hubert-Roux, B. Paupy, S. Marceau,C.P. Rüger, C. Afonso, P. Giusti – Faraday Discussions, 2019, 218, pp.417-430, DOI: 10.1039/C8FD00239H

028 Comprehensive Petroporphyrin Identification in Crude Oils Using Highly Selective Electron Transfer Reactions in MALDI-FTICR-MS – J.S. Ramírez-Pradilla, C. Blanco-Tirado, M. Hubert-Roux, P. Giusti, C. Afonso, M.Y. Combariza – Energy and Fuels, 2019, 33 (5), pp.3899-3907, DOI: 10.1021/acs.energyfuels.8b04325

027 Structural Study of Analogues of Titan’s Haze by Trapped Ion Mobility Coupled with a Fourier Transform Ion Cyclotron Mass Spectrometer – C.P. Rüger, J. Maillard, J. Le Maître, M. Ridgeway, C.J. Thompson, I.  Schmitz-Afonso, T. Gautier, N. Carrasco,M. A. Park, P. Giusti, C. Afonso – JASMS, 2019, 30 (7), pp.1169-1173, DOI: 10.1007/s13361-019-02205-7

026 Speciation of metals in asphaltenes by high-performance thin-layer chromatography and laser ablation inductively coupled plasma-mass spectrometry – R. Moulian, S. Gutierrez Sama, C. Garnier, S. Mounicou, M. Enrico, X. Jaurand, R. Lobinski, P. Giusti, B. Bouyssiere, C. Barrère-Mangote – Energy and Fuels, 2019, 33 (7), pp.6060-6068, DOI: 10.1021/acs.energyfuels.9b00676

025 Analysis of Petroleum Products by Gel Permeation Chromatography Coupled Online with Inductively Coupled Plasma Mass Spectrometry and Offline with Fourrier Transform Ion Cyclotron Resonance Mass Spectrometry, – J. Putman, S. Gutierrez Sama, C. Barrère-Mangote, R; Rodgers, R. Lobinski, A. Marshall, B. Bouyssiere,, P. Giusti – Energy and Fuels, 2018, 32 (12), pp.12198-12204, DOI: 10.1021/acs.energyfuels.8b02788

024 The impact of H-bonds and porphyrins on asphaltene aggregation as revealed by molecular dynamics simulation, – H. Santos Silva, A. Al Farra, G. Vallverdu, D; Begue, B. Bouyssiere,, I. Baraille – Energy and Fuels, 2018, 32 (11), pp.11152-11164, DOI: 10.1021/acs.energyfuels.8b01901

023 18th International Conference on Petroleum Phase Behavior and Fouling, P. Giustí, B. Bouyssiere, H. Carrier, C. Afonso – Energy and Fuels, 2018, 32 (3), pp. 2641, DOI: 10.1021/acs.energyfuels.8b00610

022 Sensitivity of the Molecular Architecture of Asphaltenes to Aggregation Under Desalting Conditions: The Effect of the Temperature and Pressure, – H. Santos Silva, A. Alfarra, G. Vallverdu, D. Bégué, B. Bouyssiere, I. Baraille – Energy and Fuels, 2018, 32 (3), pp.2681-2692, DOI: 10.1021/acs.energyfuels.7b02728

021 Molecular Fingerprints and Speciation in Crude Oils revealed by Molecular and Elemental Mass Spectrometry, keystone between Petroleomics, Metalopetroleomics, and Petrointeractomics, – S. Gutiérrez Sama, M. Farenc, C. Barrère-Mangote, R. Lobinski, C. Afonso, B. Bouyssiere, P. Giusti – Energy and Fuels, 2018, 32 (4), pp.4593-4605, DOI: 10.1021/acs.energyfuels.7b03218

020 Recent trends in element speciation analysis of crude oils and heavy petroleum fractions – S. Gutierrez Sama, C. Barrère-Mangote, P. Giusti, B. Bouyssiere, R. Lobinski – TrAC Trends in Analytical Chemistry, 2018, 104, pp.69-76, – DOI: 10.1016/j.trac.2017.10.014

019 The role of metalloporphyrins on the physical-chemical properties of petroleum fluids – Hugo Santos Silva, Ana C.R. Sodero, Jean-Pierre Korb, Ahmad Alfarra, Pierre Giusti, Germain Vallverdu, Didier Bégué, Isabelle Baraille, Brice Bouyssiere – Fuel, 2017, 188, pp.374-381, DOI: 10.1016/j.fuel.2016.10.065

018 Size Distributions of Sulfur, Vanadium, and Nickel Compounds in Crude Oils, Residues, and Their Saturate, Aromatic, Resin, and Asphaltene Fractions Determined by Gel Permeation Chromatography Inductively Coupled Plasma High-Resolution Mass Spectrometry – German Gascon, Vicmary Vargas, Llinaber Feo, Olga Castellano, Jimmy Castillo, Pierre Giusti, Socrates Acevedo, Charles-Philippe Lienemann, Brice Bouyssiere – Energy and Fuels, 2017, 31(8), pp.7783-7788, DOI: 10.1021/acs.energyfuels.7b00527

017 Characterization of Crude Oil Interfacial Material Isolated by the Wet Silica Method. Part 1: Gel Permeation Chromatography Inductively Coupled Plasma High-Resolution Mass Spectrometry Analysis, – L.M. Ligiero, P. Bouriat, C. Dicharry, N. Passade-Boupat, P.M. Lalli, R.P. Rodgers, C. Barrère-Mangote, P. Giusti, B. Bouyssiere – Energy and Fuels, 2017, 31 (2), pp.1065-1071, DOI: 10.1021/acs.energyfuels.6b02899

016 Characterization of Crude Oil Interfacial Material Isolated by the Wet Silica Method. Part 2: Dilatational and Shear Interfacial Properties – L.M. Ligiero, C. Dicharry, N. Passade-Boupat, B. Bouyssiere, P.M. Lalli, R.P. Rodgers, C. Barrére-Mangote, P. Giusti, P. Bouriat – Energy and Fuels, 2017, 31 (2), pp.1072-1081, DOI: 10.1021/acs.energyfuels.6b02897

015 Characterization of polyolefin pyrolysis species produced under ambient conditions by Fourier transform ion cyclotron resonance mass spectrometry  and ion mobility – mass spectrometry – M. Farenc, M. Witt, K. Craven, C. Barrère-Mangote, C. Afonso, P. Giusti – JASMS, 2017, 28, pp.507-514, DOI: 10.1007/s13361-016-1572-0

014 Effective ion mobility peak width as an indicator of isomeric species distribution in complex mixtures using ion mobility – mass spectrometry – M. Farenc, B. Paupy, S. Marceau, E. Riches, C. Afonso, P. Giusti – JASMS, 2017, 28, pp.2476-2482, DOI: 10.1007/s13361-017-1749-1

013 The role of metalloporphyrins on the physical- chemical properties of petroleum fluids – H. Santos Silva, A. C. R. Sodero, J.-P Korb, A. Alfarra, P. Giusti, G. Vallverdu, D. Bégué, I. Baraille, B. Bouyssiere – Fuel, 2017, 188, pp.274-381, DOI: 10.1016/j.fuel.2016.10.065

012 Study of the Size Distribution of Sulfur, Vanadium, and Nickel Compounds in Crude Oils, Residues and their SARA fractions by Gel Permeation Chromatography Inductively Coupled Plasma High Resolution Mass Spectrometry – G. Gascon, V. Vargas, L. Feo, O. Castellano, J. Castillo, P. Giusti, C.-P. Lienemann, B. Bouyssiere – Energy and Fuels, 2017, 31 (8), pp.7783-7788, DOI: 10.1021/acs.energyfuels.7b00527

011 Comparison of atmospheric pressure ionization for the analysis of heavy petroleum fractions with ion mobility – mass spectrometry – M. Farenc, Y. E. Corilo, P. M. Lalli, E. Riches, R. P. Rodgers, C. Afonso, P. Giusti – Energy and Fuels, 2016, 30 (11), pp.8896–8903, DOI: 10.1021/acs.energyfuels.6b01191

010 Study of the aggregation of metal-complexes with asphaltenes using Gel Permeation Chromatography Inductively Coupled Plasma High Resolution Mass Spectrometry – S. Gutierrez Sama, A. Desprez, G. Krier, C.-P. Lienemann, J. Barbier, R. Lobinski, C. Barrère-Mangote, P. Giusti, B. Bouyssiere – Energy and Fuels, 2016, 30 (9), pp.6907-6912, DOI: 10.1021/acs.energyfuels.6b00559

009 Molecular Dynamics Study of Nanoaggregation in Asphaltene Mixtures: Effects of the N, O, and S Heteroatoms H. Santos Silva, A. C. R. Sodero, B. Bouyssiere, H. Carrier, J.-P. Korb, A. Alfarra, G. Vallverdu, D. Bégué, I. Baraille – Energy and Fuels, 2016, 30 (7), pp.5656-5664, DOI: 10.1021/acs.energyfuels.6b01170

008 Investigation of the Effect of Sulfur Heteroatom on Asphaltene Aggregation – C. R. Sodero, H. Santos Silva, P. Guevara Level, B. Bouyssiere, J.-P. Korb, H. Carrier, A. Alfarra, D. Bégué, I. Baraille – Energy and Fuels, 2016, 30 (6), pp. 4758-4766, DOI: 10.1021/acs.energyfuels.6b00757

007 Petroleomics by Direct Analysis in Real Time-Mass Spectrometry – W. Romao, L. V. Tose, B. G. Vaz, S. G. Sama, R. Lobinski, P. Giusti, H. Carrier, B. Bouyssiere – JASMS, 2016, 27 (1), pp.182-185, DOI: 10.1007/s13361-015-1266-z

006 Comparison of cryogenic and differential flow (forward and reverse fill/flush) modulators and applications to the analysis of heavy petroleum cuts by high-temperature comprehensive gas chromatography – Chloé Duhamel, Pascal Cardinael, Valérie Peulon-Agasse, Roger Firor, Laurent Pascaud, Gaelle Semard-Jousset, Pierre Giusti, Vincent Livadiris – Journal of Chromatography A, 2015, 1387(27), pp.95-103, DOI: 10.1016/j.chroma.2015.01.095

005 Atmospheric solid analysis probe mass spectrometry vs electrospray tandem mass spectrometry of polydimethylsiloxanes in positive and negative ionization modes – T. Fouquet, C. Barrère-Mangote, M. Farenc, C. Afonso, P. Giusti – Rapid Communication in Mass Spectrometry, 2015, 29 (10), pp.982-986, DOI: 10.1002/rcm.7182

004 Rapid analysis of polyester and polyethylene blends by ion mobility-mass spectrometry – C. Barrère, W. Selmi, M. Hubert-Roux, T. Coupin, B. Assumani, C. Afonso, P. Giusti – Polymer Chemistry, 2014, 5 (11), pp.3576-3582, DOI: 10.1039/C4PY00164H

003 Study of the size distribution of sulfur, vanadium and nickel compounds in four crude oils and their distillation cuts by Gel Permeation Chromatography Inductively Coupled Plasma High Resolution Mass Spectrometry – A. Desprez, B. Bouyssiere, C. Arnaudguilhem, G. Krier, L. Vernex-Loset, P. Giusti – Energy and Fuels, 2014, 28 (6), pp.3730-3737, DOI: 10.1021/ef500571f

002 Identification of ion series using ion mobility mass spectrometry: The example of alkyl-benzothiophene and alkyl-dibenzothiophene ions in diesel fuels – F. Maire, K. Neeson, R. Denny, M McCullagh, C Lange, C. Afonso, P. Giusti – Analytical Chemistry, 2013, 85 (11), pp.5530-5534, DOI: 10.1021/ac400731d

001 Atmospheric solid analysis probe-ion mobility mass spectrometry of polypropylene – C. Barrère, F. Maire, C. Afonso, P. Giusti – Analytical Chemistry, 2012, 84 (21), pp. 9349-9354, DOI: 10.1021/ac302109q