jeremie zaffran

Publications

Article dans une revue (15)

Investigating the Effect of Morphology on Nanoparticle Catalyst Reactivity: Example of Anthraquinone Hydrogenation J. Zaffran,J. Yu,Sébastien Paul,Q. Y. Gu,J. Yu ChemCatChem, 2025, ChemCatChem, 17 (10), pp.e202500093. ⟨10.1002/cctc.202500093⟩ Article dans une revue hal-05168980v1
Stoichiometric Selective Carbonylation of Methane to Acetic Acid by Chemical Looping Yinghao Wang,Chunyang Dong,M. Shamzhy,Maya Marinova,Z. X. Guoet al. ACS Catalysis, 2025, ACS Catal., 15 (4), pp.3116-3125. ⟨10.1021/acscatal.4c07095⟩ Article dans une revue hal-05139511v1
Atomic-Scale Insights into Cu-Modified ZrO&lt;sub&gt;2&lt;/sub&gt; Catalysts: The Crucial Role of Surface Clusters in Phenol Carboxylation with CO&lt;sub&gt;2&lt;/sub&gt; Kaihua Zhang,Sébastien Paul,Jérémie Zaffran Catalysts, 2025, Catalysts, 15 (9), ⟨10.3390/catal15090902⟩ Article dans une revue hal-05383104v1
Upgrading the Density Functional Theory with Machine Learning for the Fast Prediction of Polyaromatic Reactivity at Bimetallic Catalysts Jérémie Zaffran,Minyang Jiao,Raphaël Wischert,Stéphane Streiff,Sébastien Paul Journal of Physical Chemistry C, 2024, 128 (12), pp.5084-5092. ⟨10.1021/acs.jpcc.4c00461⟩ Article dans une revue hal-04786885v1
Unveiling the phenol direct carboxylation reaction mechanism at ZrO2 surface Kaihua Zhang,Changru Ma,Sebastien Paul,Jeremie Zaffran Molecular Catalysis, 2024, 569 (1), pp.114606. ⟨10.1016/j.mcat.2024.114606⟩ Article dans une revue hal-04786879v1
Photocatalytic dihydroxylation of light olefins to glycols by water. Chunyang Dong,Yinghao Wang,Z. Deng,W. Wang,Maya Marinovaet al. Nature Communications, 2024, Nature Communications, 15, pp.8210. ⟨10.1038/s41467-024-52461-9⟩ Article dans une revue hal-04773090v1
Deoxydehydration of glycerol to allyl alcohol catalysed by ceria-supported rhenium oxide Karen Silva Vargas,Jeremie Zaffran,Marcia Araque,Masahiro Sadakane,Benjamin Katryniok Molecular Catalysis, 2023, 535, pp.112856. ⟨10.1016/j.mcat.2022.112856⟩ Article dans une revue hal-04304243v1
Identifying Metal–Halogen Bonding for Hydrogen-Induced Acid Generation in Bifunctional Catalysis Yong Zhou,Martine Trentesaux,Maya Marinova,Sergei Chernyak,Jean-Charles Morinet al. ACS Catalysis, 2023, 13 (9), pp.6351-6364. ⟨10.1021/acscatal.3c00845⟩ Article dans une revue hal-04304242v1
Direct Photocatalytic Synthesis of Acetic Acid from Methane and CO at Ambient Temperature Using Water as Oxidant Chunyang Dong,Maya Marinova,Karima Ben Tayeb,Olga Safonova,Yong Zhouet al. Journal of the American Chemical Society, 2023, 145 (2), pp.1185-1193. ⟨10.1021/jacs.2c10840⟩ Article dans une revue hal-04304252v1
Catalytic selective oxidation of isobutane in a decoupled redox-process Li Zhang,Jérémie Zaffran,Franck Dumeignil,Sébastien Paul,Axel Löfberget al. Applied Catalysis A : General, 2022, 643, pp.118798. ⟨10.1016/j.apcata.2022.118798⟩ Article dans une revue hal-03792695v1
Hydrogen Oxidation on Ni-Based Electrocatalysts: The Effect of Metal Doping Elena Davydova,Jérémie Zaffran,Kapil Dhaka,Maytal Toroker,Dario Dekel Catalysts, 2018, 8 (10), pp.454. ⟨10.3390/catal8100454⟩ Article dans une revue hal-03031651v1
Towards more accurate prediction of activation energies for polyalcohol dehydrogenation on transition metal catalysts in water Jérémie Zaffran,Carine Michel,Françoise Delbecq,Philippe Sautet Catalysis Science & Technology, 2016, 6 (17), pp.6615 - 6624. ⟨10.1039/c6cy00865h⟩ Article dans une revue hal-01641046v1
Trade-Off between Accuracy and Universality in Linear Energy Relations for Alcohol Dehydrogenation on Transition Metals Jérémie Zaffran,Carine Michel,Françoise Delbecq,Philippe Sautet Journal of Physical Chemistry C, 2015, 119 (23), pp.12988-12998. ⟨10.1021/acs.jpcc.5b01703⟩ Article dans une revue hal-01230739v1
Role of water on metal catalyst performance for ketone hydrogenation. A join experimental and theoretical study on levulinic acid conversion into gamma-valerolactone Carine Michel,Jérémie Zaffran,Agnieszka M. Ruppert,Joanna Matras-Michalska,Marcin Jędrzejczyket al. Chemical Communications, 2014, 50 (83), pp.12403-12580. ⟨10.1039/C4CC04401K⟩ Article dans une revue hal-01230464v1
Linear Energy Relations As Predictive Tools for Polyalcohol Catalytic Reactivity Jérémie Zaffran,Carine Michel,Florian Auneau,Françoise Delbecq,Philippe Sautet ACS Catalysis, 2014, 4 (2), pp.464-468. ⟨10.1021/cs4010503⟩ Article dans une revue hal-01121422v1

HDR (1)

Avancées et Défis de la Chimie Computationnelle en Catalyse Hétérogène : De la DFT à l’Intelligence Artificielle Jérémie Zaffran Catalyse. Université de Lille, 2025 HDR tel-05400365v1

Communication dans un congrès (7)

Machine learning assisted computational design of solid catalyst for complex biomass molecule transformation Jeremie Zaffran ACS Fall 2023 "Harnessing the power of data", American Chemical Society, Aug 2023, San Francisco (CA, USA), United States. ⟨10.1021/scimeetings.3c10059⟩ Communication dans un congrès hal-04376695v1
Theoretical studies of biomass derivatives transformation by metallic heterogeneous catalysts. A micro-solvation approach Carine Michel,Jérémie Zaffran,Françoise Delbecq,Philippe Sautet 249th ACS National Meeting, Mar 2015, Denver, United States Communication dans un congrès hal-02024604v1
Role of water on metal catalyst performance for ketone hydrogenation. A join experimental and theoretical study on levulinic acid conversion into gamma-valerolactone Carine Michel,Jérémie Zaffran,Joanna Matras-Michalska,Marcin Jędrzejczyk,Agnieszka M. Ruppert 249th ACS National Meeting, Mar 2015, Denver, United States Communication dans un congrès hal-02047202v1
Role of water on metal catalyst performance for ketone hydrogenation. A join experimental and theoretical study on levulinic acid conversion into gamma-valerolactone Carine Michel,Jérémie Zaffran,Joanna Matras-Michalska,Marcin Jędrzejczyk,Agnieszka M. Ruppertet al. 249th ACS National Meeting, Mar 2015, Denver, United States Communication dans un congrès hal-02047203v1
Theoretical studies of biomass derivatives by metallic heterogeneous catalysts. A micro-solvation approach. Carine Michel,Jérémie Zaffran,Françoise Delbecq,Philippe Sautet International Conference on Theoretical Aspects of Catalysis, Jun 2014, Londres, United Kingdom Communication dans un congrès hal-02024587v1
Mechanistic insights for the catalytic transformation of glycerol Carine Michel,Florian Auneau,Jérémie Zaffran,Françoise Delbecq,C. Pinelet al. 7th International Conference on Environmental Catalysis, Sep 2012, Lyon, France Communication dans un congrès hal-02022020v1
Alcohols dehydrogenation at close-packed surface Carine Michel,Jérémie Zaffran,Florian Auneau,Siwar Chibani,Françoise Delbecqet al. Tailored surfaces in operando conditions, Mar 2012, Autrans, France Communication dans un congrès hal-02024523v1

Thèse (1)

Linear energy relations for biomass transformation under heterogeneous catalysis : a fast prediction of polyalcohol dehydrogenation on transition metals Jérémie Zaffran Other. Ecole normale supérieure de lyon - ENS LYON, 2014. English. ⟨NNT : 2014ENSL0891⟩ Thèse tel-00992665v1

Poster de conférence (2)

Alcohols dehydrogenation at close-packed surface Carine Michel,Jérémie Zaffran,Florian Auneau,Siwar Chibani,Françoise Delbecqet al. International Conference on Theoretical Aspects of Catalysis, Jul 2014, Londres, United Kingdom Poster de conférence hal-02022024v1
Alcohols dehydrogenation at close-packed surface Carine Michel,Jérémie Zaffran,Florian Auneau,Siwar Chibani,Françoise Delbecqet al. International Conference on Theoretical Aspects of Catalysis, Jun 2012, Vlissingen, Netherlands Poster de conférence hal-02024368v1