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Théophile Gaudin
Théophile Gaudin
Support Scientist, Dassault Systèmes
Verified email at 3ds.com
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Cited by
Year
Impact of the chemical structure on amphiphilic properties of sugar-based surfactants: A literature overview
T Gaudin, H Lu, G Fayet, A Berthauld-Drelich, P Rotureau, G Pourceau, ...
Advances in Colloid and Interface Science 270, 87-100, 2019
802019
Mixture descriptors toward the development of quantitative structure–property relationship models for the flash points of organic mixtures
T Gaudin, P Rotureau, G Fayet
Industrial & Engineering Chemistry Research 54 (25), 6596-6604, 2015
622015
Investigating the impact of sugar-based surfactants structure on surface tension at critical micelle concentration with structure-property relationships
T Gaudin, P Rotureau, I Pezron, G Fayet
Journal of Colloid and Interface Science 516, 162-171, 2018
462018
New QSPR models to predict the critical micelle concentration of sugar-based surfactants
T Gaudin, P Rotureau, I Pezron, G Fayet
Industrial & Engineering Chemistry Research 55 (45), 11716-11726, 2016
382016
Combining mixing rules with QSPR models for pure chemicals to predict the flash points of binary organic liquid mixtures
T Gaudin, P Rotureau, G Fayet
Fire Safety Journal 74, 61-70, 2015
322015
Theoretical study of effects of solvents, ligands, and anions on separation of trivalent lanthanides and actinides
K Niu, F Yang, T Gaudin, H Ma, W Fang
Inorganic Chemistry 60 (13), 9552-9562, 2021
192021
COSMO plex: self-consistent simulation of self-organizing inhomogeneous systems based on COSMO-RS
A Klamt, J Schwöbel, U Huniar, L Koch, S Terzi, T Gaudin
Physical Chemistry Chemical Physics 21 (18), 9225-9238, 2019
192019
Simultaneous optimization of donor/acceptor pairs and device specifications for nonfullerene organic solar cells using a QSPR model with morphological descriptors
Y Wen, Y Liu, B Yan, T Gaudin, J Ma, H Ma
The Journal of Physical Chemistry Letters 12 (20), 4980-4986, 2021
182021
Non-equilibrium micelles formed by sugar-based surfactants under their Krafft temperature
H Lu, I Pezron, T Gaudin, A Drelich
Colloids and Surfaces A: Physicochemical and Engineering Aspects 540, 167-176, 2018
182018
The macroscopic viscosity approximation: A first-principle relationship between molecular diffusion and viscosity
T Gaudin, H Ma
AIP Advances 10 (3), 2020
162020
Prediction of Pourbaix diagrams of quinones for redox flow battery by COSMO-RS
T Gaudin, JM Aubry
Journal of Energy Storage 49, 104152, 2022
152022
Conformations of n-alkyl-α/β-d-glucopyranoside surfactants: Impact on molecular properties
T Gaudin, P Rotureau, I Pezron, G Fayet
Computational and Theoretical Chemistry 1101, 20-29, 2017
152017
COSMO‐RS as an effective tool for predicting the physicochemical properties of fragrance raw materials
T Dupeux, T Gaudin, C Marteau‐Roussy, JM Aubry, V Nardello‐Rataj
Flavour and Fragrance Journal 37 (2), 106-120, 2022
122022
The Salinity-Phase-Inversion method (SPI-slope): A straightforward experimental approach to assess the hydrophilic-lipophilic-ratio and the salt-sensitivity of surfactants
G Lemahieu, JF Ontiveros, T Gaudin, V Molinier, JM Aubry
Journal of Colloid and Interface Science 608, 549-563, 2022
102022
A molecular contact theory for simulating polarization: application to dielectric constant prediction
T Gaudin, H Ma
Physical Chemistry Chemical Physics 21 (27), 14846-14857, 2019
82019
Exploring direct prediction of surface tension from COSMO-RS theory
T Gaudin
Chemical Physics Letters 706, 308-310, 2018
82018
Shear viscosity prediction of alcohols, hydrocarbons, halogenated, carbonyl, nitrogen-containing, and sulfur compounds using the variable force fields
Q Zhu, Y Gu, L Hu, T Gaudin, M Fan, J Ma
The Journal of Chemical Physics 154 (7), 2021
72021
Estimating the adsorption efficiency of sugar-based surfactants from QSPR models
T Gaudin, P Rotureau, I Pezron, G Fayet
International Journal of Quantitative Structure-Property Relationships …, 2019
62019
Anticipating dissolution issues of sugar‐based surfactants through a decision tree approach
T Gaudin, G Fayet, P Rotureau, I Pezron
Journal of Surfactants and Detergents 21 (6), 835-843, 2018
52018
Predictive model based on the evidence theory for assessing critical micelle concentration property
A Samet, T Gaudin, H Lu, A Wadouachi, G Pourceau, E Van Hecke, ...
Information Processing and Management of Uncertainty in Knowledge-Based …, 2016
52016
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