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Agilio Padua
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Nanostructural organization in ionic liquids
JNA Canongia Lopes, AAH Pádua
The Journal of Physical Chemistry B 110 (7), 3330-3335, 2006
20592006
Modeling ionic liquids using a systematic all-atom force field
JN Canongia Lopes, J Deschamps, AAH Pádua
The journal of physical chemistry B 108 (6), 2038-2047, 2004
15142004
Molecular force field for ionic liquids composed of triflate or bistriflylimide anions
JN Canongia Lopes, AAH Pádua
The Journal of Physical Chemistry B 108 (43), 16893-16898, 2004
10352004
Density and viscosity of several pure and water-saturated ionic liquids
J Jacquemin, P Husson, AAH Padua, V Majer
Green Chemistry 8 (2), 172-180, 2006
9732006
Molecular force field for ionic liquids III: Imidazolium, pyridinium, and phosphonium cations; chloride, bromide, and dicyanamide anions
JN Canongia Lopes, AAH Pádua
The Journal of Physical Chemistry B 110 (39), 19586-19592, 2006
5912006
Nonpolar, polar, and associating solutes in ionic liquids
JN Canongia Lopes, MF Costa Gomes, AAH Pádua
The Journal of Physical Chemistry B 110 (34), 16816-16818, 2006
5412006
Molecular solutes in ionic liquids: a structural perspective
AAH Padua, MF Costa Gomes, JNA Canongia Lopes
Accounts of chemical research 40 (11), 1087-1096, 2007
5222007
CL&P: A generic and systematic force field for ionic liquids modeling
JN Canongia Lopes, AAH Pádua
Theoretical Chemistry Accounts 131, 1-11, 2012
3652012
Molecular force field for ionic liquids IV: Trialkylimidazolium and alkoxycarbonyl-imidazolium cations; alkylsulfonate and alkylsulfate anions
JN Canongia Lopes, AAH Pádua, K Shimizu
The Journal of Physical Chemistry B 112 (16), 5039-5046, 2008
3282008
Understanding the role of co-solvents in the dissolution of cellulose in ionic liquids
JM Andanson, E Bordes, J Devémy, F Leroux, AAH Pádua, MFC Gomes
Green Chemistry 16 (5), 2528-2538, 2014
2922014
Prediction of ionic liquid properties. I. Volumetric properties as a function of temperature at 0.1 MPa
J Jacquemin, R Ge, P Nancarrow, DW Rooney, MF Costa Gomes, ...
Journal of Chemical & Engineering Data 53 (3), 716-726, 2008
2812008
Enhancing effect of dimethylamine in sulfuric acid nucleation in the presence of water–a computational study
V Loukonen, T Kurtén, IK Ortega, H Vehkamäki, AAH Padua, K Sellegri, ...
Atmospheric Chemistry and Physics 10 (10), 4961-4974, 2010
2782010
Improvement of quality in publication of experimental thermophysical property data: Challenges, assessment tools, global implementation, and online support
RD Chirico, M Frenkel, JW Magee, V Diky, CD Muzny, AF Kazakov, ...
Journal of Chemical & Engineering Data 58 (10), 2699-2716, 2013
2672013
Liquid structure of the ionic liquid 1, 3-dimethylimidazolium bis {(trifluoromethyl) sulfonyl} amide
M Deetlefs, C Hardacre, M Nieuwenhuyzen, AAH Padua, O Sheppard, ...
The Journal of Physical Chemistry B 110 (24), 12055-12061, 2006
2522006
Effect of fluorination and size of the alkyl side-chain on the solubility of carbon dioxide in 1-alkyl-3-methylimidazolium bis (trifluoromethylsulfonyl) amide ionic liquids
D Almantariotis, T Gefflaut, AAH Padua, JY Coxam, MF Costa Gomes
The Journal of Physical Chemistry B 114 (10), 3608-3617, 2010
1872010
Liquid-phase exfoliation of phosphorene: design rules from molecular dynamics simulations
V Sresht, AAH Padua, D Blankschtein
ACS nano 9 (8), 8255-8268, 2015
1852015
Solvation and stabilization of metallic nanoparticles in ionic liquids
AS Pensado, AAH Pádua
Angewandte Chemie International Edition 37 (50), 8683-8687, 2011
1822011
Polarity, Viscosity, and Ionic Conductivity of Liquid Mixtures Containing [C4C1im][Ntf2] and a Molecular Component
JN Canongia Lopes, MF Costa Gomes, P Husson, AAH Pádua, ...
The Journal of Physical Chemistry B 115 (19), 6088-6099, 2011
1792011
Molecular force field for ionic liquids V: Hydroxyethylimidazolium, dimethoxy-2-methylimidazolium, and fluoroalkylimidazolium cations and bis (fluorosulfonyl) amide …
K Shimizu, D Almantariotis, MFC Gomes, AAH Pádua, ...
The Journal of Physical Chemistry B 114 (10), 3592-3600, 2010
1682010
Self-assembled nanostructures in ionic liquids facilitate charge storage at electrified interfaces
X Mao, P Brown, C Červinka, G Hazell, H Li, Y Ren, D Chen, R Atkin, ...
Nature materials 18 (12), 1350-1357, 2019
1672019
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