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ANR project: Code decision (reference) : ANR-18-CE05-0028
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Insights on the formation and dissociation mechanisms of cyclopentane hydrate obtained by using calorimetry and optical microscopy

Raj Kumar Ramamoorthy , Sébastien Teychené , Isaac Rodríguez-Ruiz , Jean-Philippe Torré
Chemical Engineering Research and Design, 2022, 177, pp.117-122. ⟨10.1016/j.cherd.2021.10.027⟩
Journal articles hal-03760630v1
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Simulation of Liquids with the Tight-Binding Density-Functional Approach and Improved Atomic Charges

Jérôme Cuny , Jesus C. Calatayud , Narjes Ansari , Ali A. Hassanali , Mathias Rapacioli , et al.
Journal of Physical Chemistry B, 2020, 124 (34), pp.7421-7432. ⟨10.1021/acs.jpcb.0c04167⟩
Journal articles hal-02959734v1
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Accurate SCC-DFTB Parametrization of Liquid Water with Improved Atomic Charges and Iterative Boltzmann Inversion

Nicolas Cinq , Aude Simon , Fernand Louisnard , Jérôme Cuny
Journal of Physical Chemistry B, 2023, 127 (35), pp.7590-7601. ⟨10.1021/acs.jpcb.3c03479⟩
Journal articles hal-04189470v1
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Experimental monitoring of CO2 hydrate slurry crystallization by heat flux rate determination in a jacketed reactor

Véronique Osswald , Pascal Clain , L. Fournaison , Anthony Delahaye
International Journal of Heat and Mass Transfer, 2023, 217, pp.124665. ⟨10.1016/j.ijheatmasstransfer.2023.124665⟩
Journal articles hal-04211411v1

Contact angle measurements on cyclopentane hydrates

Fanny Thomas , Didier Dalmazzone , Jeffrey Morris
Chemical Engineering Science, 2020, pp.116022. ⟨10.1016/j.ces.2020.116022⟩
Journal articles hal-02917346v1