LORENZO GONTRANI

Professore associato

email: lorenzo.gontrani@uniroma2.it





Produzione scientifica

2108/450783 - 2026 - Household chemicals as key ingredients: the addition of sodium percarbonate to tin chloride in deep eutectic solvents leads to SnO2 nanoparticles very efficient for dye photocatalytic degradation
Gontrani, Lorenzo; Cotirlan, Francesca Alessandra; Lembo, Angelo; Carbone, Marilena - 01 - Articolo su rivista
rivista: INORGANIC CHEMISTRY COMMUNICATIONS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. - - issn: 1387-7003 - wos: WOS:001703782100003 (1) - scopus: 2-s2.0-105034347396 (1)

2108/467503 - 2026 - A Versatile KF/EG Deep Eutectic Solvent that Lunges PET Depolymerization Forward through Reusability, Tunable Selectivity and Energy Efficiency
Ricci, Cosimo; Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: CHEMICAL ENGINEERING JOURNAL ADVANCES (Amsterdam: Elsevier B.V.) pp. - - issn: 2666-8211 - wos: (0) - scopus: (0)

2108/465423 - 2026 - Temperature Effects on Defect-Induced Luminescence in ZnO Nanocrystals
Gontrani, Lorenzo; Casoli, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS (Elsevier Science Limited:Oxford Fulfillment Center, PO Box 800, Kidlington Oxford OX5 1DX United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: asianfo@elsevier.com, tcb@elsevier.co.UK, INTERNET: http://www.elsevier.com, http://www.elsevier.com/locate/shpsa/, Fax: 011 44 1865 843010) pp. - - issn: 0022-3697 - wos: (0) - scopus: 2-s2.0-105040664843 (0)

2108/441883 - 2025 - Asymmetric antipodal β-functionalized Push–Pull porphyrins based on β,β′-fused imidazole rings: synthesis, DFT, photophysical studies, and the base-dependent equilibrium characterization in nonaqueous solutions
Lembo, Angelo; Demingo, Miriam; Gontrani, Lorenzo; Ricci, Cosimo; Leoni, Alessandro; Carbone, Marilena; Tagliatesta, Pietro - 01 - Articolo su rivista
rivista: INORGANIC CHEMISTRY (Washington, DC: American Chemical Society) pp. 24450-24468 - issn: 0020-1669 - wos: WOS:001635304500001 (1) - scopus: 2-s2.0-105025202751 (1)

2108/440383 - 2025 - Strategies for the Implementation of Chenodeoxycholic Acid in Natural Polymer-Based Hydrogels for Stable and Low-Light Effective Quasi-Solid Electrolytes for Aqueous Dye-Sensitized Solar Cells
Casoli, Lorenzo; Lembo, Angelo; Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: ACS APPLIED ENERGY MATERIALS (Washington DC : American Chemical Society) pp. 17451-17466 - issn: 2574-0962 - wos: WOS:001625304100001 (0) - scopus: (0)

2108/414463 - 2025 - Templating effect travelling on the edge between ionic liquid and DES: the case of fluorescent ZnO nanostructures in choline nitrate
Gontrani, Lorenzo; Casoli, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: MATERIALS ADVANCES (Cambridge: Royal Society of Chemistry) pp. - - issn: 2633-5409 - wos: WOS:001438825700001 (1) - scopus: 2-s2.0-105002289864 (2)

2108/384303 - 2024 - Fluorescence properties of DES borne nanometric ZnO: temperature and structure effects
Gontrani, Lorenzo; Carbone, Marilena - 02 - Intervento a convegno
congresso: SCI2024 - Chemistry Elements of Future (Milano)

2108/388265 - 2024 - Heck reaction between free base 2-Br-porphyrin and vinyl-ferrocene derivatives. Electrochemical and spectroscopic characterisation of β-functionalised alpha and trans-vinyl-ferrocene porphyrin derivatives. A comparative study
Demingo, Miriam; Lembo, Angelo; Petrella, Greta; Gontrani, Lorenzo; Limosani, Francesca; Carbone, Marilena; Cicero, Daniel Oscar; Tagliatesta, Pietro - 01 - Articolo su rivista
rivista: NEW JOURNAL OF CHEMISTRY ([London] : Royal Society of Chemistry, [1998]-) pp. - - issn: 1369-9261 - wos: WOS:001337081900001 (3) - scopus: 2-s2.0-85206454839 (4)

2108/371563 - 2024 - Metal Ion Microwave-Assisted Depolymerization of Poly(Ethylene Terephthalate): A Zinc Salts-Based Deep Eutectic Solvent as Case Study
Ricci, Cosimo; Gontrani, Lorenzo; Ciufolini, Giorgia; Lembo, Angelo; Casoli, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: CRYSTALS (Basel : Molecular Diversity Preservation International) pp. - - issn: 2073-4352 - wos: WOS:001254422000001 (3) - scopus: 2-s2.0-85197656109 (6)

2108/353563 - 2024 - Inulin-Coated ZnO Nanoparticles: A Correlation between Preparation and Properties for Biostimulation Purposes
Gontrani, Lorenzo; Casoli, Lorenzo; Ricci, Cosimo; Lembo, Angelo; Donia, Domenica Tommasa; Carbone, Marilena - 01 - Articolo su rivista
rivista: INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES (Basel: MDPI Center) pp. 2703- - issn: 1422-0067 - wos: WOS:001182805100001 (5) - scopus: 2-s2.0-85187435053 (7)

2108/357003 - 2024 - Green zinc/galactomannan-based hydrogels push up the photovoltage of quasi solid aqueous dye sensitized solar cells
Gontrani, Lorenzo; Donia, Domenica Tommasa; Carbone, Marilena - 01 - Articolo su rivista
rivista: SOLAR ENERGY (Elsevier Science Limited:Oxford Fulfillment Center, PO Box 800, Kidlington Oxford OX5 1DX United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: asianfo@elsevier.com, tcb@elsevier.co.UK, INTERNET: http://www.elsevier.com, http://www.elsevier.com/locate/shpsa/, Fax: 011 44 1865 843010) pp. - - issn: 0038-092X - wos: WOS:001218053400001 (9) - scopus: 2-s2.0-85188546738 (10)

2108/373083 - 2024 - Voronoi Tessellation as a Tool for Predicting the Formation of Deep Eutectic Solvents
Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: JOURNAL OF CHEMICAL INFORMATION AND MODELING (Washington D.C.: American Chemical Society, ©2005-) pp. 7017-7026 - issn: 1549-9596 - wos: WOS:001261313000001 (3) - scopus: 2-s2.0-85197395983 (4)

2108/379763 - 2024 - Ionic Twin Nanostructural Comparison: Propylammonium Butanoate vs. Butylammonium Propanoate and Their Interactions with Water
Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: MATERIALS (Basel: Molecular Diversity Preservation International-MDPI) pp. - - issn: 1996-1944 - wos: WOS:001305978100001 (0) - scopus: 2-s2.0-85202447577 (0)

2108/328523 - 2023 - CuO nanoparticles and microaggregates: an experimental and computational study of structure and electronic properties
Gontrani, Lorenzo; Tagliatesta, Pietro; Carbone, Marilena - 01 - Articolo su rivista
rivista: MATERIALS (Basel: Molecular Diversity Preservation International-MDPI) pp. - - issn: 1996-1944 - wos: WOS:001033068100001 (20) - scopus: 2-s2.0-85164797276 (19)

2108/343083 - 2023 - A new push–pull dye for semi-transparent p-type dye-sensitized solar cells: tuning conjugation by sexithiophene chain engineering
Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: SOLAR ENERGY (Elsevier Science Limited:Oxford Fulfillment Center, PO Box 800, Kidlington Oxford OX5 1DX United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: asianfo@elsevier.com, tcb@elsevier.co.UK, INTERNET: http://www.elsevier.com, http://www.elsevier.com/locate/shpsa/, Fax: 011 44 1865 843010) pp. - - issn: 0038-092X - wos: WOS:001110426600001 (5) - scopus: 2-s2.0-85175446875 (4)

2108/330703 - 2023 - MD Simulations and X-Ray scattering
Gontrani, Lorenzo; Carbone, Marilena - 03 - Contributo in libro
libro: Elsevier Reference collection in chemistry, molecular sciences and chemical engineering - (9780124095472)

2108/307755 - 2023 - Novel Synthesis of Zinc Oxide Nanoparticles from Type IV Deep Eutectic Solvents
Gontrani, Lorenzo; Donia, Domenica Tommasa; Tagliatesta, Pietro; Carbone, Marilena - 01 - Articolo su rivista
rivista: INORGANICA CHIMICA ACTA (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598 Editore precedente:Prof Ugo Croatto Luogo pubbl. Padova Ultimo luogo pubblicazione: Lausanne.) pp. 1-8 - issn: 0020-1693 - wos: WOS:000921508700003 (38) - scopus: 2-s2.0-85140996847 (42)

2108/306134 - 2022 - NOVEL SYNTHESIS OF METAL OXIDE NANOPARTICLES FROM TYPE IV DEEP EUTECTIC SOLVENTS
Gontrani, Lorenzo; Carbone, Marilena; Donia, Domenica Tommasa; Tagliatesta, Pietro - 02 - Intervento a convegno
congresso: Inorg2022 - XLVIII Congresso Nazionale di Chimica Inorganica (Pisa)

2108/310055 - 2022 - Critical assessment of the sustainability of deep eutectic solvents: a case study on six choline chloride-based mixtures
Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: ACS OMEGA (Washington, D.C. : American Chemical Society, 2016-) pp. 47449-47461 - issn: 2470-1343 - wos: WOS:000897448500001 (80) - scopus: 2-s2.0-85144483708 (93)

2108/307615 - 2022 - Isoindigo dyes functionalized with terminal electron-withdrawing groups: computational, optical and electrical characterization
Carbone, Marilena; Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: DYES AND PIGMENTS (Elsevier Applied Science:An Imprint of Elsevier Science Ltd, The Boulevard, Langford Lane, Kidlington Oxford OX5 1GB United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: nlinfo-f@elsevier.nl OR usinfo-f@elsevier.com OR forinfo-kyf04035@niftyserve.or.jp, INTERNET: http://www.elsevier.nl/, Fax: 011 44 1865 843010) pp. - - issn: 0143-7208 - wos: WOS:000877779500003 (6) - scopus: 2-s2.0-85138463347 (16)

2108/305695 - 2022 - Highly specific silver ion detection by fluorescent carbon quantum dots
Gontrani, Lorenzo; Tagliatesta, Pietro; Carbone, Marilena - 01 - Articolo su rivista
rivista: CHEMOSENSORS (Basel : MDPI) pp. - - issn: 2227-9040 - wos: WOS:000856277200001 (16) - scopus: 2-s2.0-85138695502 (17)

2108/306334 - 2022 - Stepping away from serendipity in Deep Eutectic Solvent formation: prediction from precursors ratio
Carbone, Marilena; Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. - - issn: 0167-7322 - wos: WOS:000890276700016 (16) - scopus: 2-s2.0-85138463347 (16)

2108/293774 - 2022 - Recent advances in the synthesis of inorganic materials using environmentally friendly media
Gontrani, Lorenzo; Tagliatesta, Pietro; Donia, Domenica Tommasa; Carbone, Marilena - 01 - Articolo su rivista
rivista: MOLECULES (Basel: MDPI Berlin: Springer, 1996-) pp. - - issn: 1420-3049 - wos: WOS:000781459800001 (13) - scopus: 2-s2.0-85127464802 (14)

2108/289451 - 2022 - Novel thienyl DPP derivatives functionalized with terminal electron acceptor groups: synthesis, optical properties and OFET performance
Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: CHEMISTRY-A EUROPEAN JOURNAL (Wiley-VCH Verlag GmBH:PO Box 101161, D 69451 Weinheim Germany:011 49 6201 606147, EMAIL: service@wiley-vch.de, INTERNET: http://www.wiley-vch.de, Fax: 011 49 6201 606328) pp. - - issn: 0947-6539 - wos: WOS:000772905900001 (20) - scopus: 2-s2.0-85127257147 (19)

2108/254873 - 2021 - Physical-chemical studies on putrescine (butane-1,4-diamine) and its solutions: experimental and computational investigations
Carbone, Marilena; Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. - - issn: 0167-7322 - wos: WOS:000610834000033 (6) - scopus: 2-s2.0-85095588525 (5)

2108/273947 - 2021 - Room temperature syntheses of ZnO and their structures
Donia, Domenica Tommasa; Tagliatesta, Pietro; Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: SYMMETRY (Basel : Molecular Diversity Preservation International) pp. - - issn: 2073-8994 - wos: WOS:000643625300001 (30) - scopus: 2-s2.0-85105275847 (31)

2108/279307 - 2021 - Detection of heavy metals in water using graphene oxide quantum dots: an experimental and theoretical study
Gontrani, Lorenzo; Pulci, Olivia; Carbone, Marilena; Pizzoferrato, Roberto; Prosposito, Paolo - 01 - Articolo su rivista
rivista: MOLECULES (Basel: MDPI Berlin: Springer, 1996-) pp. - - issn: 1420-3049 - wos: WOS:000701863500001 (13) - scopus: 2-s2.0-85114891000 (16)

2108/293765 - 2021 - How do arenediazonium salts behave in deep eutectic solvents? A combined experimental and computational approach
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. - - issn: 0167-7322 - wos: WOS:000691312600051 (15) - scopus: 2-s2.0-85110119798 (15)

2108/293770 - 2021 - The unseen evidence of reduced ionicity: the elephant in (the) room temperature ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. - - issn: 0167-7322 - wos: WOS:000632343700093 (46) - scopus: 2-s2.0-85098683859 (50)

2108/293767 - 2021 - New insights into chloromethyl-oxirane and chloromethyl-thiirane in liquid and solid phase from low-temperature infrared spectroscopy and ab initio modeling
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: SPECTROCHIMICA ACTA. PART A, MOLECULAR AND BIOMOLECULAR SPECTROSCOPY (Elsevier Science Limited:Oxford Fulfillment Center, PO Box 800, Kidlington Oxford OX5 1DX United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: asianfo@elsevier.com, tcb@elsevier.co.UK, INTERNET: http://www.elsevier.com, http://www.elsevier.com/locate/shpsa/, Fax: 011 44 1865 843010) pp. - - issn: 1386-1425 - wos: WOS:000601062500016 (1) - scopus: 2-s2.0-85092757134 (1)

2108/274781 - 2021 - Laser vs. thermal treatments of green pigment PG36: coincidence and toxicity of processes
Gontrani, Lorenzo; Tagliatesta, Pietro; Carbone, Marilena - 01 - Articolo su rivista
rivista: ARCHIVES OF TOXICOLOGY (Springer Verlag Germany:Tiergartenstrasse 17, D 69121 Heidelberg Germany:011 49 6221 3450, EMAIL: g.braun@springer.de, INTERNET: http://www.springer.de, Fax: 011 49 6221 345229) pp. 2367-2383 - issn: 0340-5761 - wos: WOS:000647018400001 (6) - scopus: 2-s2.0-85105879837 (6)

2108/255910 - 2020 - New insights into the structure of glycols and derivatives: a comparative X-ray diffraction, Raman and molecular dynamics study of ethane-1,2-diol, 2-methoxyethan-1-ol and 1,2-dimethoxy ethane
Gontrani, Lorenzo; Tagliatesta, Pietro; Agresti, Antonio; Pescetelli, Sara; Carbone, Marilena - 01 - Articolo su rivista
rivista: CRYSTALS (Basel : Molecular Diversity Preservation International) pp. - - issn: 2073-4352 - wos: WOS:000592902500001 (8) - scopus: 2-s2.0-85095772129 (9)

2108/293711 - 2020 - Choline hydrogen dicarboxylate ionic liquids by X-ray scattering, vibrational spectroscopy and molecular dynamics: H-fumarate and H-maleate and their conformations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: MOLECULES (Basel: MDPI Berlin: Springer, 1996-) pp. - - issn: 1420-3049 - wos: WOS:000589378800001 (12) - scopus: 2-s2.0-85094983422 (14)

2108/275821 - 2020 - Excitonic fine structure in emission of linear carbon chains
Pulci, Olivia; Grassano, Davide; Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: NANO LETTERS (Washington, DC : American Chemical Society, c2001-) pp. 6502-6509 - issn: 1530-6984 - wos: WOS:000571442000036 (32) - scopus: 2-s2.0-85090613423 (36)

2108/295149 - 2020 - New pyran-based molecules as both n- and p-type sensitizers in semi-transparent Dye Sensitized Solar Cells
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: DYES AND PIGMENTS (Elsevier Applied Science:An Imprint of Elsevier Science Ltd, The Boulevard, Langford Lane, Kidlington Oxford OX5 1GB United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: nlinfo-f@elsevier.nl OR usinfo-f@elsevier.com OR forinfo-kyf04035@niftyserve.or.jp, INTERNET: http://www.elsevier.nl/, Fax: 011 44 1865 843010) pp. - - issn: 0143-7208 - wos: WOS:000514214600014 (24) - scopus: 2-s2.0-85076632940 (24)

2108/295130 - 2020 - Dendrimer crown-ether tethered multi-wall carbon nanotubes support methyltrioxorhenium in the selective oxidation of olefins to epoxides
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: RSC ADVANCES (London: Royal Society of Chemistry) pp. 17185-17194 - issn: 2046-2069 - wos: WOS:000533969200043 (11) - scopus: 2-s2.0-85084603236 (13)

2108/295151 - 2020 - A new electrochemical sensor for extra-virgin olive oils classification
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: FOOD CONTROL (Oxford: Elsevier Sci Ldt London: Butterworth Scientific) pp. - - issn: 0956-7135 - wos: WOS:000500052400019 (8) - scopus: 2-s2.0-85072556453 (8)

2108/253752 - 2020 - A combined electrochemical, infrared and EDXD tool to disclose Deep Eutectic Solvents formation when one precursor is liquid: Glyceline as case study
Gontrani, Lorenzo; Carbone, Marilena - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. 114292- - issn: 0167-7322 - wos: WOS:000583948500103 (26) - scopus: 2-s2.0-85091204670 (27)

2108/295128 - 2019 - Microscopic structural and dynamic features in triphilic room temperature ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: FRONTIERS IN CHEMISTRY (Lausanne : Frontiers Media S.A., 2013-) pp. - - issn: 2296-2646 - wos: WOS:000466569600001 (31) - scopus: 2-s2.0-85064625769 (29)

2108/294611 - 2019 - Coupled hydroxyl and ether functionalisation in EAN derivatives: the effect of hydrogen bond donor/acceptor groups on the structural heterogeneity studied with X-ray diffractions and fixed charge/polarizable simulations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 11464-11475 - issn: 1463-9076 - wos: WOS:000471025900061 (2) - scopus: 2-s2.0-85066733377 (2)

2108/295123 - 2019 - In-depth physico-chemical and structural investigation of a dicarboxylic acid/choline chloride natural deep eutectic solvent (nades): a spotlight on the importance of a rigorous preparation procedure
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: ACS SUSTAINABLE CHEMISTRY & ENGINEERING (Washington DC: American Chemical Society, c2013-) pp. 12536-12543 - issn: 2168-0485 - wos: WOS:000475838100065 (50) - scopus: 2-s2.0-85071463955 (59)

2108/295118 - 2019 - Dual effect of humidity on cesium lead bromide: enhancement and degradation of perovskite films
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MATERIALS CHEMISTRY. A (Cambridge : RSC Publishing, 2012-) pp. 12292-12302 - issn: 2050-7488 - wos: WOS:000472465300065 (87) - scopus: 2-s2.0-85065983724 (91)

2108/295120 - 2019 - Biologically friendly room temperature ionic liquids and nanomaterials for the development of innovative enzymatic biosensors: Part II
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: TALANTA (-Oxford, United Kingdom: Elsevier Science Limited Oxford: Pergamon, 1958-) pp. 26-31 - issn: 0039-9140 - wos: WOS:000456899700004 (25) - scopus: 2-s2.0-85054827906 (34)

2108/295126 - 2019 - Mesoscopic structural organization in fluorinated pyrrolidinium-based room temperature ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. - - issn: 0167-7322 - wos: WOS:000482247900077 (15) - scopus: 2-s2.0-85067228792 (18)

2108/295147 - 2019 - Medium range interactions evidences in compounds with aliphatic lateral chain: 1-pentanoic acid, 1-pentanol and pentylammonium nitrate as test cases
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. - - issn: 0009-2614 - wos: WOS:000487794200005 (4) - scopus: 2-s2.0-85072262751 (4)

2108/294749 - 2018 - Structure and dynamics of propylammonium nitrate-acetonitrile mixtures: an intricate multi-scale system probed with experimental and theoretical techniques
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000429359200041 (17) - scopus: 2-s2.0-85045125022 (18)

2108/294747 - 2018 - Hydrogen bonding features in cholinium-based protic ionic liquids from molecular dynamics simulations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 2635-2645 - issn: 1520-6106 - wos: WOS:000427331400019 (40) - scopus: 2-s2.0-85043511566 (40)

2108/294741 - 2018 - First evidence of electrode reconstruction in mesoporous NiO after operation as photocathode of dye-sensitized solar cells
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMISTRYSELECT (John Wiley & Sons, Inc) pp. 6729-6736 - issn: 2365-6549 - wos: WOS:000436798700003 (7) - scopus: 2-s2.0-85049249090 (7)

2108/294743 - 2018 - New experimental evidences regarding conformational equilibrium in ammonium-bis(trifluoromethanesulfonyl)imide ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMPHYSCHEM (Weinheim : Wiley-VCH-Verl.) pp. 2776-2781 - issn: 1439-7641 - wos: WOS:000448062900021 (6) - scopus: 2-s2.0-85050620384 (6)

2108/294609 - 2018 - X-Ray structure and ionic conductivity studies of anhydrous and hydrated choline chloride and oxalic acid deep eutectic solvents
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 30120-30124 - issn: 1463-9076 - wos: WOS:000453231100005 (41) - scopus: 2-s2.0-85058559895 (43)

2108/294745 - 2018 - Nanoscale organization in the fluorinated room temperature ionic liquid: tetraethyl ammonium (trifluoromethanesulfonyl)(nonafluorobutylsulfonyl)imide
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000432853800020 (21) - scopus: 2-s2.0-85041794067 (25)

2108/294739 - 2018 - Choline-amino acid ionic liquids: past and recent achievements about the structure and properties of these really "green" chemicals
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: BIOPHYSICAL REVIEWS (Heidelberg; Berlin: Springer) pp. 873-880 - issn: 1867-2469 - wos: (0) - scopus: 2-s2.0-85048131152 (70)

2108/294751 - 2018 - Mesoscopic structural organization in fluorinated room temperature ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: COMPTES RENDUS CHIMIE (Editions Scientifique & Medical Elsevier:23 Rue Linois, F 75724 Paris Cedex 15 France:011 33 1 71724646, INTERNET: http://www.elsevier.fr, Fax: 011 33 1 71724664) pp. 757-770 - issn: 1631-0748 - wos: WOS:000453646000006 (12) - scopus: 2-s2.0-85042649311 (12)

2108/294737 - 2018 - Communication: anion-specific response of mesoscopic organization in ionic liquids upon pressurization
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000434837600002 (5) - scopus: 2-s2.0-85048440067 (6)

2108/294724 - 2017 - Inhomogeneity in ethylammonium nitrate-acetonitrile binary mixtures: the highest "Low q excess" reported to date
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS (Washington, DC: American Chemical Society) pp. 3512-3522 - issn: 1948-7185 - wos: WOS:000407191300011 (27) - scopus: 2-s2.0-85026814889 (29)

2108/294722 - 2017 - The Opposite effect of water and n-methyl-2-pyrrolidone cosolvents on the nanostructural organization of ethylammonium butanoate ionic liquid: a small- and wide-angle X-ray scattering and molecular dynamics simulations study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 6399-6407 - issn: 1520-6106 - wos: WOS:000405253000013 (4) - scopus: 2-s2.0-85024503797 (4)

2108/294726 - 2017 - Bio ionic liquids and water mixtures: a structural study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: RSC ADVANCES (London: Royal Society of Chemistry) pp. 19338-19344 - issn: 2046-2069 - wos: WOS:000399240400067 (15) - scopus: 2-s2.0-85017122006 (16)

2108/294728 - 2017 - A structural and theoretical study of the alkylammonium nitrates forefather: liquid methylammonium nitrate
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 304-309 - issn: 0009-2614 - wos: WOS:000407404400050 (9) - scopus: 2-s2.0-85022336180 (10)

2108/294601 - 2017 - Water and hexane in an ionic liquid: computational evidence of association under high pressure
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 8661-8666 - issn: 1463-9076 - wos: WOS:000399004700004 (7) - scopus: 2-s2.0-85019888971 (7)

2108/294607 - 2017 - Intriguing transport dynamics of ethylammonium nitrate-acetonitrile binary mixtures arising from nano-inhomogeneity
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 27212-27220 - issn: 1463-9076 - wos: WOS:000413290500007 (26) - scopus: 2-s2.0-85042009455 (27)

2108/294733 - 2017 - A joint experimental and computational study on ethylammonium nitrate-ethylene glycol 1:1 mixture: structural, kinetic, dynamic and spectroscopic properties
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. 2-8 - issn: 0167-7322 - wos: WOS:000392676600002 (16) - scopus: 2-s2.0-84995939746 (17)

2108/294731 - 2017 - An X-ray and computational study of liquid pentylammonium nitrate
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 38-43 - issn: 0009-2614 - wos: WOS:000412453700007 (6) - scopus: 2-s2.0-85028935082 (6)

2108/294605 - 2017 - Unexpected proton mobility in the bulk phase of cholinium-based ionic liquids: new insights from theoretical calculations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 11869-11880 - issn: 1463-9076 - wos: WOS:000401640600016 (33) - scopus: 2-s2.0-85024479877 (34)

2108/294735 - 2017 - Effect of alkyl chain length in protic ionic liquids: an AIMD perspective
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: MOLECULAR PHYSICS (Taylor & Francis Limited:Rankine Road, Basingstoke RG24 8PR United Kingdom:011 44 1256 813035, EMAIL: madeline.sims@tandf.co.uk, info@tandf.co.uk, INTERNET: http://www.tandf.co.uk, Fax: 011 44 1256 330245) pp. 1582-1589 - issn: 0026-8976 - wos: WOS:000402045600014 (25) - scopus: 2-s2.0-85016981540 (25)

2108/294603 - 2017 - X-ray and molecular dynamics studies of butylammonium butanoate-water binary mixtures
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 1975-1981 - issn: 1463-9076 - wos: WOS:000394426400030 (16) - scopus: 2-s2.0-85017189039 (16)

2108/294712 - 2016 - Structural and vibrational study of 2-{MethoxyEthylAmmonium} Nitrate (2-{OMeEAN}): Interpretation of experimental results with ab initio molecular dynamics
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000381153600033 (9) - scopus: 2-s2.0-84978535969 (9)

2108/294599 - 2016 - A new insight into the nanostructure of alkylammonium alkanoates based ionic liquids in water
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 11497-11502 - issn: 1463-9076 - wos: WOS:000374786300092 (18) - scopus: 2-s2.0-84967142272 (18)

2108/294597 - 2016 - Pressure-induced mesoscopic disorder in protic ionic liquids: first computational study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 2297-2302 - issn: 1463-9076 - wos: WOS:000369506000003 (45) - scopus: 2-s2.0-84955328282 (47)

2108/294706 - 2016 - Theoretical study of ionic liquids based on the cholinium cation: ab initio simulations of their condensed phases
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000372974600022 (35) - scopus: 2-s2.0-84960922160 (37)

2108/294716 - 2016 - Choline salicylate ionic liquid by X-ray scattering, vibrational spectroscopy and molecular dynamics
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. 39-49 - issn: 0167-7322 - wos: WOS:000376800500005 (24) - scopus: 2-s2.0-84959019388 (26)

2108/294718 - 2016 - Low-Q peak in X-ray patterns of choline-phenylalanine and -homophenylalanine: a combined effect of chain and stacking
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 99-101 - issn: 0009-2614 - wos: WOS:000384787600017 (30) - scopus: 2-s2.0-84981507328 (31)

2108/294714 - 2016 - Chloromethyl-oxirane and chloromethyl-thiirane in liquid phase: a joint experimental and quantum chemical study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 24-31 - issn: 0301-0104 - wos: WOS:000376445800004 (5) - scopus: 2-s2.0-84966389444 (8)

2108/294708 - 2016 - Micro- and mesoscopic structural features of a bio-based choline-amino acid ionic liquid
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: RSC ADVANCES (London: Royal Society of Chemistry) pp. 34737-34743 - issn: 2046-2069 - wos: WOS:000374049700076 (22) - scopus: 2-s2.0-84964692785 (25)

2108/294710 - 2016 - Nanoscale density fluctuations in ionic liquid binary mixtures with nonamphiphilic compounds: first experimental evidence
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 10540-10546 - issn: 1520-6106 - wos: WOS:000385606700013 (23) - scopus: 2-s2.0-84991727586 (24)

2108/294720 - 2016 - Does high pressure induce structural reorganization in linear alcohols? A computational answer
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMPHYSCHEM (Weinheim : Wiley-VCH-Verl.) pp. 3023-3029 - issn: 1439-7641 - wos: WOS:000386790100012 (18) - scopus: 2-s2.0-85027923598 (19)

2108/294704 - 2015 - Structural studies on choline-carboxylate bio-ionic liquids by x-ray scattering and molecular dynamics
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000361843900043 (30) - scopus: 2-s2.0-84942155486 (31)

2108/294617 - 2015 - Is a medium-range order pre-peak possible for ionic liquids without an aliphatic chain?
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: RSC ADVANCES (London: Royal Society of Chemistry) pp. 50938-50941 - issn: 2046-2069 - wos: WOS:000356303000035 (31) - scopus: 2-s2.0-84935905567 (33)

2108/294613 - 2015 - Heterogeneity of propyl-ammonium nitrate solid phases obtained under high pressure
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS (Elsevier Science Limited:Oxford Fulfillment Center, PO Box 800, Kidlington Oxford OX5 1DX United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: asianfo@elsevier.com, tcb@elsevier.co.UK, INTERNET: http://www.elsevier.com, http://www.elsevier.com/locate/shpsa/, Fax: 011 44 1865 843010) pp. 13-16 - issn: 0022-3697 - wos: WOS:000357233300003 (17) - scopus: 2-s2.0-84934908654 (17)

2108/294621 - 2015 - Two different models to predict ionic-liquid diffraction patterns: Fixed-charge versus polarizable potentials
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMPHYSCHEM (Weinheim : Wiley-VCH-Verl.) pp. 197-203 - issn: 1439-7641 - wos: WOS:000347239200020 (29) - scopus: 2-s2.0-84920143464 (29)

2108/294595 - 2015 - Cholinium-amino acid based ionic liquids: a new method of synthesis and physico-chemical characterization
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 20687-20698 - issn: 1463-9076 - wos: WOS:000359237800028 (167) - scopus: 2-s2.0-84938629561 (175)

2108/294615 - 2015 - Interaction and dynamics of ionic liquids based on choline and amino acid anions
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000356623000021 (56) - scopus: 2-s2.0-84932101832 (57)

2108/294619 - 2015 - Self-assembly of catecholic moiety-containing cationic random acrylic copolymers
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 8369-8379 - issn: 1520-6106 - wos: WOS:000357623400015 (18) - scopus: 2-s2.0-84947287006 (18)

2108/294542 - 2014 - Interaction of a long alkyl chain protic ionic liquid and water
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000336832900040 (37) - scopus: 2-s2.0-84901746601 (37)

2108/349308 - 2014 - The Structure of Ionic Liquids
Gontrani, Lorenzo - 05 - Curatele

2108/93247 - 2014 - Higher fullerenes: Compositional analysis by EDXD and molecular dynamics
Carbone, Marilena; Gontrani, Lorenzo - 03 - Contributo in libro
libro: AIP Conference Proceedings 1603 - (978-0-7354-1237-8)

2108/294552 - 2014 - NMR, calorimetry, and computational studies of aqueous solutions of N-Methyl-2-pyrrolidone
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 10493-10502 - issn: 1520-6106 - wos: WOS:000341337500019 (21) - scopus: 2-s2.0-84907838512 (23)

2108/294555 - 2014 - Thermo-physical properties of ammonium-based ionic liquid + N-methyl-2-pyrrolidone mixtures at 298.15K
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: FLUID PHASE EQUILIBRIA (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 49-54 - issn: 0378-3812 - wos: WOS:000345729100008 (19) - scopus: 2-s2.0-84907830976 (19)

2108/294534 - 2014 - FTIR spectra and density functional theory PED assignments of oxiranes in Ar matrix at 12 K
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: SPECTROCHIMICA ACTA. PART A, MOLECULAR AND BIOMOLECULAR SPECTROSCOPY (Elsevier Science Limited:Oxford Fulfillment Center, PO Box 800, Kidlington Oxford OX5 1DX United Kingdom:011 44 1865 843000, 011 44 1865 843699, EMAIL: asianfo@elsevier.com, tcb@elsevier.co.UK, INTERNET: http://www.elsevier.com, http://www.elsevier.com/locate/shpsa/, Fax: 011 44 1865 843010) pp. 558-567 - issn: 1386-1425 - wos: WOS:000331342500073 (10) - scopus: 2-s2.0-84891609426 (11)

2108/294544 - 2014 - Amino Acid Anions in Organic Ionic Compounds. An ab Initio Study of Selected Ion Pairs
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 2471-2486 - issn: 1520-6106 - wos: WOS:000332756200018 (46) - scopus: 2-s2.0-84897694459 (51)

2108/294550 - 2014 - The structural organization of N-methyl-2-pyrrolidone plus water mixtures: a densitometry, x-ray diffraction, and molecular dynamics study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000334169000043 (34) - scopus: 2-s2.0-84897536370 (34)

2108/93230 - 2014 - Brominated carbon black: An EDXD study
Carbone, Marilena; Gontrani, Lorenzo - 03 - Contributo in libro
libro: AIP Conference Proceedings 1603 - (978-0-7354-1237-8X)

2108/294528 - 2013 - Tautomerism in liquid 1,2,3-triazole: a combined energy-dispersive X-ray diffraction, molecular dynamics, and FTIR study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: STRUCTURAL CHEMISTRY (New York,: Springer New York,: Plenum Press Deerfield Beach FL: VCH, ©1990-) pp. 933-943 - issn: 1040-0400 - wos: WOS:000319019200024 (24) - scopus: 2-s2.0-84879118932 (24)

2108/294532 - 2013 - A Combined theoretical and experimental study of solid octyl and decylammonium chlorides and of their aqueous solutions
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 7806-7818 - issn: 1520-6106 - wos: WOS:000321236200033 (36) - scopus: 2-s2.0-84879586961 (43)

2108/294530 - 2013 - Conformational isomerisms and nano-aggregation in substituted alkylammonium nitrates ionic liquids: an x-ray and computational study of 2-methoxyethylammonium nitrate
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000319290800038 (29) - scopus: 2-s2.0-84877943789 (32)

2108/294522 - 2012 - Role of ionic liquids in protein refolding: native/fibrillar versus treated lysozyme
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: RSC ADVANCES (London: Royal Society of Chemistry) pp. 12329-12336 - issn: 2046-2069 - wos: WOS:000312148500045 (36) - scopus: 2-s2.0-84871069218 (39)

2108/294524 - 2012 - NMR investigation of imidazolium-based ionic liquids and their aqueous mixtures
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMPHYSCHEM (Wiley-VCH Verlag GmBH:PO Box 101161, D 69451 Weinheim Germany:011 49 6201 606147, EMAIL: service@wiley-vch.de, INTERNET: http://www.wiley-vch.de, Fax: 011 49 6201 606328) pp. 1339-1346 - issn: 1439-4235 - wos: WOS:000302167100031 (45) - scopus: 2-s2.0-84859248027 (46)

2108/294520 - 2012 - The structure of liquid N-methyl pyrrolidone probed by x-ray scattering and molecular simulations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000300551000019 (18) - scopus: 2-s2.0-84857530257 (19)

2108/294526 - 2012 - The interpretation of diffraction patterns of two prototypical protic ionic liquids: a challenging task for classical molecular dynamics simulations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 13024-13032 - issn: 1520-6106 - wos: WOS:000310482800015 (58) - scopus: 2-s2.0-84868227268 (58)

2108/294516 - 2012 - Mesoscopic structural heterogeneities in room-temperature ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS (Washington, DC: American Chemical Society) pp. 27-33 - issn: 1948-7185 - wos: WOS:000298908100004 (367) - scopus: 2-s2.0-84855461898 (379)

2108/294518 - 2012 - Liquid structure of 1-ethyl-3-methylimidazolium alkyl sulfates by x-ray scattering and molecular dynamics
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 13448-13458 - issn: 1520-6106 - wos: WOS:000311192000020 (43) - scopus: 2-s2.0-84869200579 (43)

2108/293713 - 2012 - Crystal polymorphism of hexylammonium chloride and structural properties of its mixtures with water
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 2104-2113 - issn: 1520-6106 - wos: WOS:000301156300010 (33) - scopus: 2-s2.0-84857394979 (33)

2108/294508 - 2011 - Thermal and structural properties of ethylammonium chloride and its mixture with water
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 4887-4899 - issn: 1520-6106 - wos: WOS:000289824300001 (35) - scopus: 2-s2.0-79955504347 (36)

2108/294512 - 2011 - Structural flexibility and role of vicinal 2-thienyl rings in 2, 3-dicyano-5,6-di(2-thienyl)-1,4-pyrazine, (CN)(2)Th(2)Pyz , its palladium(II) complex (CN)(2)Th(2)Pyz(PdCl2)(2) , and the related pentametallic pyrazinoporphyrazines (PdCl2)(4)Th(8)TPyzPzM (M = Mg-II(H2O), Zn-II)
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: INORGANIC CHEMISTRY (Washington, DC: American Chemical Society) pp. 12116-12125 - issn: 0020-1669 - wos: WOS:000297274600034 (8) - scopus: 2-s2.0-82355190396 (7)

2108/294514 - 2011 - Crystal polymorphism of propylammonium chloride and structural properties of its mixture with water
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 11805-11815 - issn: 1520-6106 - wos: WOS:000295700700006 (15) - scopus: 2-s2.0-80054684611 (15)

2108/294510 - 2011 - Liquid structure of 1-alkyl-3-methylimidazolium-hexafluorophosphates by wide angle x-ray and neutron scattering and molecular dynamics
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000288597700046 (79) - scopus: 2-s2.0-79953179356 (82)

2108/294092 - 2010 - Selected chemical-physical properties and structural heterogeneities in 1-ethyl-3-methylimidazolium alkyl-sulfate room temperature ionic liquids
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 259-262 - issn: 0009-2614 - wos: WOS:000278650000013 (81) - scopus: 2-s2.0-77954212780 (84)

2108/294096 - 2010 - Structural determination of ionic liquids with theoretical methods: C(8)mimBr and C(8)mimCl: strength and weakness of current force fields
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS (Washington, DC: American Chemical Society) pp. 1095-1100 - issn: 1948-7185 - wos: WOS:000277041300017 (29) - scopus: 2-s2.0-77950569507 (31)

2108/294094 - 2010 - Structural properties of 1-Alkyl-3-methylimidazolium Bis{(trifluoromethyl)sulfonyl}amide Ionic Liquids: X-ray diffraction data and molecular dynamics simulations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 16398-16407 - issn: 1520-6106 - wos: WOS:000284990700044 (93) - scopus: 2-s2.0-78650099286 (92)

2108/294086 - 2009 - Overcoming the inadequacy of X-ray powder diffraction in reliable hydrogen location with the aid of first principles calculations: crystal structure determination of orotaldehyde monohydrate
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY (American Chemical Society:1155 Sixteenth Street Northwest:Washington, DC 20036:(800)227-5558, EMAIL: service@acs.org, INTERNET: http://www.pubs.acs.org, Fax: (614)447-3671) pp. 353-359 - issn: 1089-5639 - wos: WOS:000262140100045 (4) - scopus: 2-s2.0-62149112206 (5)

2108/294080 - 2009 - Morphology and intermolecular dynamics of 1-alkyl-3-methylimidazolium bis{(trifluoromethane)sulfonyl}amide ionic liquids: structural and dynamic evidence of nanoscale segregation
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICS. CONDENSED MATTER ([Bristol] : IOP Publishing, 1989-) pp. - - issn: 1361-648X - wos: WOS:000270353800023 (321) - scopus: 2-s2.0-84881660311 (331)

2108/294088 - 2009 - An energy dispersive x-ray scattering and molecular dynamics study of liquid dimethyl carbonate
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THE JOURNAL OF CHEMICAL PHYSICS (American Institute of Physics:2 Huntington Quadrangle, Suite 1NO1:Melville, NY 11747:(800)344-6902, (631)576-2287, EMAIL: subs@aip.org, INTERNET: http://www.aip.org, Fax: (516)349-9704) pp. - - issn: 0021-9606 - wos: WOS:000273217000033 (49) - scopus: 2-s2.0-73649102767 (47)

2108/294082 - 2009 - Liquid structure of trihexyltetradecylphosphonium chloride at ambient temperature: an X-ray scattering and simulation study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 9235-9240 - issn: 1520-6106 - wos: WOS:000267651600027 (97) - scopus: 2-s2.0-67650072736 (98)

2108/294075 - 2009 - Hydration of diazoles in water solution: pyrazole: a theoretical and X-ray diffraction study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 9431-9439 - issn: 1463-9076 - wos: WOS:000270795500015 (9) - scopus: 2-s2.0-70350074489 (10)

2108/29183 - 2009 - UV-vis spectra of the anticancer camptothecin family drugs in aqueous solution: specific spectroscopic signatures unraveled by a combined computational and experimental study
Chillemi, Giovanni; Gontrani, Lorenzo; Castelli, Silvia; Desideri, Alessandro - 01 - Articolo su rivista
rivista: JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL (American Chemical Society, Washington, D.C.) pp. 5369-5375 - issn: 1520-6106 - wos: WOS:000265269100005 (39) - scopus: 2-s2.0-66349091349 (38)

2108/294070 - 2008 - Computational methods applied to the discovery of stem cell factor ligands
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: THEORETICAL CHEMISTRY ACCOUNTS (Springer Verlag Germany:Tiergartenstrasse 17, D 69121 Heidelberg Germany:011 49 6221 3450, EMAIL: g.braun@springer.de, INTERNET: http://www.springer.de, Fax: 011 49 6221 345229) pp. 523-531 - issn: 1432-881X - wos: WOS:000256765900023 (0) - scopus: 2-s2.0-45449120048 (1)

2108/294068 - 2008 - A study of cyclohexane, piperidine and morpholine with X-ray diffraction and molecular simulations
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR LIQUIDS (Amsterdam, Netherlands: Elsevier BV) pp. 23-28 - issn: 0167-7322 - wos: WOS:000254322000004 (27) - scopus: 2-s2.0-39149101791 (28)

2108/294066 - 2008 - Synthesis, biological evaluation, and molecular modeling studies of rebeccamycin analogues modified in the carbohydrate moiety
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMMEDCHEM (Weinheim : Wiley-VCH-Verl..) pp. 266-279 - issn: 1860-7179 - wos: WOS:000254022600009 (19) - scopus: 2-s2.0-47649108181 (19)

2108/294064 - 2007 - Dimerisation of urea in water solution: a quantum mechanical investigation
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: PHYSICAL CHEMISTRY CHEMICAL PHYSICS (Thomas Graham House, Science Park, Cambridge: Royal Society of Chemistry) pp. 2206-2215 - issn: 1463-9076 - wos: WOS:000246368500004 (38) - scopus: 2-s2.0-34248228825 (38)

2108/294060 - 2006 - Furan and thiophene in liquid phase: an X-ray and molecular dynamics study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 256-261 - issn: 0009-2614 - wos: WOS:000237177500048 (15) - scopus: 2-s2.0-33646414779 (15)

2108/294062 - 2006 - Energy dispersive X-ray diffraction and molecular dynamics meet: the structure of liquid pyrrole
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 200-205 - issn: 0009-2614 - wos: WOS:000234530400038 (32) - scopus: 2-s2.0-29144535326 (34)

2108/294058 - 2001 - Hydrogen bonding in barbituric and 2-thiobarbituric acids: a theoretical and {FT}-{IR} study
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 293-308 - issn: 0301-0104 - wos: WOS:000171098200005 (32) - scopus: 2-s2.0-0035885039 (35)

2108/294056 - 2000 - Glycine and alanine: a theoretical study of solvent effects upon energetics and molecular response properties
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: JOURNAL OF MOLECULAR STRUCTURE. THEOCHEM (Tokyo ; Oxford ; New York ; London ; Amsterdam : Elsevier) pp. 113-127 - issn: 0166-1280 - wos: WOS:000087654500006 (93) - scopus: 2-s2.0-84961984960 (101)

2108/294054 - 1999 - Molecular aggregation phenomena in solution: an energy dispersive X-ray diffraction study of concentrated imidazole water solutions
Gontrani, Lorenzo - 01 - Articolo su rivista
rivista: CHEMICAL PHYSICS LETTERS (Elsevier BV:PO Box 211, 1000 AE Amsterdam Netherlands:011 31 20 4853757, 011 31 20 4853642, 011 31 20 4853641, EMAIL: nlinfo-f@elsevier.nl, INTERNET: http://www.elsevier.nl, Fax: 011 31 20 4853598) pp. 131-137 - issn: 0009-2614 - wos: WOS:000078660800019 (32) - scopus: 2-s2.0-0001115608 (33)

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