Personal information

Numerical simulation, Density Functional Theory (DFT), Machine learning, Heterogeneous catalysis, Renewable energy, Biomass and CO2 valoization, Solar fuel cells, Photovoltaic cells

Activities

Employment (8)

CNRS Délégation Paris Michel-Ange: Shanghai, CN

2023-01-01 to present | Researcher (E2P2L (joint CNRS-Solvay lab))
Employment
Source: Self-asserted source
Jeremie Zaffran

CNRS Délégation Ile-de-France Ouest et Nord: Meudon, Île-de-France, FR

2020-12-01 to 2023-01-01 | Charge de Recherche (CRCN) (UMI 3464)
Employment
Source: Self-asserted source
Jeremie Zaffran

ShanghaiTech University: Shanghai, CN

2018-10-01 to 2020-11-01 | Research Scientist (School of Physis and Technology)
Employment
Source: Self-asserted source
Jeremie Zaffran

Technion Israel Institute of Technology: Haifa, Haifa, IL

2014-10-01 to 2017-09-01 | Postdoc Fellow (Materials Science)
Employment
Source: Self-asserted source
Jeremie Zaffran

École Normale Supérieure: Lyon, FR

2011-05-02 to 2014-04-30 | PhD researher (Chemistry)
Employment
Source: Self-asserted source
Jeremie Zaffran

Technion – Israel Institute of Technology: Haifa, IL

2009-03-01 to 2009-09-30 | Visiting Scientist (Physics)
Employment
Source: Self-asserted source
Jeremie Zaffran

Weizmann Institute of Science: Rehovot, IL

2008-03-01 to 2008-06-30 | Visiting Scientist (Materials and Interfaces)
Employment
Source: Self-asserted source
Jeremie Zaffran

EDF Recherche et Développement Site de Chatou: Chatou, FR

2007-03-01 to 2007-07-31 | Visiting Scientist (Photovoltaic Institute of France (IPVF))
Employment
Source: Self-asserted source
Jeremie Zaffran

Education and qualifications (3)

Ecole Normale Supérieure : Lyon, FR

2011-04-30 to 2014-05-02 | PhD (Theoretical Heterogeneous Catalysis) (Chemistry)
Education
Source: Self-asserted source
Jeremie Zaffran

Paris Diderot University: Paris, FR

2008-10-01 to 2010-09-30 | Master (Nanomaterials) (Chemistry)
Education
Source: Self-asserted source
Jeremie Zaffran

Paris Diderot University: Paris, FR

2005-10-01 to 2008-09-30 | Bachelor of Science (Chemistry) (Chemistry)
Education
Source: Self-asserted source
Jeremie Zaffran

Professional activities (2)

Technion Israel Institute of Technology: Haifa, Haifa, IL

2016 | The Lady Davis fellowship
Distinction
Source: Self-asserted source
Jeremie Zaffran

Technion Israel Institute of Technology: Haifa, Haifa, IL

2016 | The Nancy and Stephen Grand Technion Energy Program grant
Distinction
Source: Self-asserted source
Jeremie Zaffran

Funding (3)

PLASTILOOP 2.0

2023 to present | Grant
Agence Nationale de la Recherche (Paris, FR)
Source: Self-asserted source
Jeremie Zaffran

SMARTDIGICAT

2021 to present | Grant
Metropole Europeenne de Lille (Lille, FR)
Source: Self-asserted source
Jeremie Zaffran

Coverage impact of Co2C reactivity in Fischer–Tropsch synthesis

2019-10 to 2020-09 | Grant
National Natural Science Foundation of China (Shanghai, CN)
GRANT_NUMBER: 21950410522
Source: Self-asserted source
Jeremie Zaffran

Works (32)

Stoichiometric Selective Carbonylation of Methane to Acetic Acid by Chemical Looping

ACS Catalysis
2025-02-21 | Journal article
Contributors: Yinghao Wang; Chunyang Dong; Mariya Shamzhy; Maya Marinova; Zhengxiao Guo; Yury G. Kolyagin; Jeremie Zaffran; Andrei Khodakov; Vitaly V. Ordomsky
Source: check_circle
Crossref

Stoichiometric selective carbonylation of methane to acetic acid by chemical looping

Zenodo
2025-02-05 | Journal article
Contributors: Yinghao Wang; Chunyang Dong; Mariya Shamzhy; Maya Marinova; Zheng Xiao Guo; Yury Kolyagin; Jeremie Zaffran; Andrei Khodakov; Vitaly Ordomsky
Source: check_circle
DataCite

Stoichiometric selective carbonylation of methane to acetic acid by chemical looping

Zenodo
2025-02-05 | Journal article
Contributors: Yinghao Wang; Chunyang Dong; Mariya Shamzhy; Maya Marinova; Zheng Xiao Guo; Yury Kolyagin; Jeremie Zaffran; Andrei Khodakov; Vitaly Ordomsky
Source: check_circle
DataCite

Unveiling the phenol direct carboxylation reaction mechanism at ZrO2 surface

Molecular Catalysis
2024-12 | Journal article
Contributors: Kaihua Zhang; Changru Ma; Sebastien Paul; Jeremie Zaffran
Source: check_circle
Crossref

Photocatalytic dihydroxylation of light olefins to glycols by water

Nature Communications
2024-09-18 | Journal article
Part of ISSN: 2041-1723
Contributors: Chunyang Dong; Yinghao Wang; Ziqi Deng; Wenchao Wang; Maya Marinova; karima ben tayeb; Jean-Charles Morin; Melanie Dubois; Martine Trentesaux; Yury Kolyagin et al.
Source: Self-asserted source
Jeremie Zaffran

Upgrading the Density Functional Theory with Machine Learning for the Fast Prediction of Polyaromatic Reactivity at Bimetallic Catalysts

The Journal of Physical Chemistry C
2024-03-28 | Journal article
Contributors: Jérémie Zaffran; Minyang Jiao; Raphaël Wischert; Stéphane Streiff; Sébastien Paul
Source: check_circle
Crossref

Direct Photocatalytic Synthesis of Acetic Acid from Methane and CO at Ambient Temperature Using Water as Oxidant

Journal of the American Chemical Society
2023 | Journal article
EID:

2-s2.0-85146484688

Part of ISSN: 15205126
Contributors: Dong, C.; Marinova, M.; Tayeb, K.B.; Safonova, O.V.; Zhou, Y.; Hu, D.; Chernyak, S.; Corda, M.; Zaffran, J.; Khodakov, A.Y. et al.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Identifying Metal–Halogen Bonding for Hydrogen-Induced Acid Generation in Bifunctional Catalysis

ACS Catalysis
2023-05-05 | Journal article | Author
Part of ISSN: 2155-5435
Part of ISSN: 2155-5435
Contributors: Yong Zhou; Martine Trentesaux; Maya Marinova; Sergei Chernyak; Jean-Charles Morin; Melanie Dubois; Samuel Eyley; Wim Thielemans; Vlad Martin-Diaconescu; Andrei Khodakov et al.
Source: Self-asserted source
Jeremie Zaffran

Deoxydehydration of glycerol to allyl alcohol catalysed by ceria-supported rhenium oxide

Molecular Catalysis
2023-01 | Journal article
Contributors: Karen Silva Vargas; Jeremie Zaffran; Marcia Araque; Masahiro Sadakane; Benjamin Katryniok
Source: check_circle
Crossref
grade
Preferred source (of 2)‎

Catalytic selective oxidation of isobutane in a decoupled redox-process

Applied Catalysis A: General
2022-08 | Journal article
Part of ISSN: 0926-860X
Contributors: Jeremie Zaffran
Source: Self-asserted source
Jeremie Zaffran
grade
Preferred source (of 2)‎

Theoretical Insights into the Formation Mechanism of Methane, Ethylene and Methanol in Fischer-Tropsch Synthesis at Co<sub>2</sub>C Surfaces

ChemCatChem
2021 | Journal article
EID:

2-s2.0-85105181811

Part of ISSN: 18673899 18673880
Contributors: Zaffran, J.; Yang, B.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Descriptor Design in the Computational Screening of Ni-Based Catalysts with Balanced Activity and Stability for Dry Reforming of Methane Reaction

ACS Catalysis
2020 | Journal article
EID:

2-s2.0-85080886082

Part of ISBN:

21555435

Contributors: Chen, S.; Zaffran, J.; Yang, B.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Dry reforming of methane over the cobalt catalyst: Theoretical insights into the reaction kinetics and mechanism for catalyst deactivation

Applied Catalysis B: Environmental
2020 | Journal article
EID:

2-s2.0-85081234917

Part of ISBN:

09263373

Contributors: Chen, S.; Zaffran, J.; Yang, B.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

First-Principles-Based Microkinetic Simulations of CO<inf>2</inf>Hydrogenation to Methanol over Intermetallic GaPd<inf>2</inf>: Method Development to Include Complex Interactions between Surface Adsorbates

Journal of Physical Chemistry C
2020 | Journal article
EID:

2-s2.0-85089429237

Part of ISBN:

19327455 19327447

Contributors: Wu, P.; Zaffran, J.; Xu, D.; Yang, B.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Fast prediction of oxygen reduction reaction activity on carbon nanotubes with a localized geometric descriptor.

Physical chemistry chemical physics : PCCP
2020-01 | Journal article
Contributors: Yang K; Zaffran J; Yang B
Source: Self-asserted source
Jeremie Zaffran via Europe PubMed Central
grade
Preferred source (of 2)‎

Role of Surface Species Interactions in Identifying the Reaction Mechanism of Methanol Synthesis from CO<inf>2</inf> Hydrogenation over Intermetallic PdIn(310) Steps

Journal of Physical Chemistry C
2019 | Journal article
EID:

2-s2.0-85067094891

Part of ISBN:

19327455 19327447

Contributors: Wu, P.; Zaffran, J.; Yang, B.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Ternary Ni-Co-Fe oxyhydroxide oxygen evolution catalysts: Intrinsic activity trends, electrical conductivity, and electronic band structure

Nano Research
2019 | Journal article
EID:

2-s2.0-85064346387

Part of ISBN:

19980000 19980124

Contributors: Stevens, M.B.; Enman, L.J.; Korkus, E.H.; Zaffran, J.; Trang, C.D.M.; Asbury, J.; Kast, M.G.; Toroker, M.C.; Boettcher, S.W.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Unveiling ionic diffusion in MgNiMnO<inf>4</inf> cathode material for Mg-ion batteries via combined computational and experimental studies

Journal of Solid State Electrochemistry
2019 | Journal article
EID:

2-s2.0-85074472381

Part of ISBN:

14330768 14328488

Contributors: Shasha, H.; Yatom, N.; Prill, M.; Zaffran, J.; Biswas, S.; Aurbach, D.; Toroker, M.C.; Ein-Eli, Y.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Efficient cationic agents for exfoliating two-dimensional nickel oxide sheets

Theoretical Chemistry Accounts
2018 | Journal article
EID:

2-s2.0-85042845465

Part of ISBN:

1432881X

Contributors: Zaffran, J.; Nagli, M.; Shehadeh, M.; Toroker, M.C.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Hydrogen oxidation on Ni-based electrocatalysts: The effect of metal doping

Catalysts
2018 | Journal article
EID:

2-s2.0-85055722044

Part of ISBN:

20734344

Contributors: Davydova, E.S.; Zaffran, J.; Dhaka, K.; Toroker, M.C.; Dekel, D.R.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Influence of Electrolyte Cations on Ni(Fe)OOH Catalyzed Oxygen Evolution Reaction

Chemistry of Materials
2017 | Journal article
EID:

2-s2.0-85020747951

Part of ISBN:

15205002 08974756

Contributors: Zaffran, J.; Stevens, M.B.; Trang, C.D.M.; Nagli, M.; Shehadeh, M.; Boettcher, S.W.; Caspary Toroker, M.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Understanding the Oxygen Evolution Reaction on a Two-Dimensional NiO<inf>2</inf> Catalyst

ChemElectroChem
2017 | Journal article
EID:

2-s2.0-85027518313

Part of ISBN:

21960216

Contributors: Zaffran, J.; Toroker, M.C.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Designing efficient doped NiOOH catalysts for water splitting with first principles calculations

ChemistrySelect
2016 | Journal article
EID:

2-s2.0-85016050592

Part of ISBN:

23656549

Contributors: Zaffran, J.; Toroker, M.C.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Three fundamental questions on one of our best water oxidation catalysts: a critical perspective

Theoretical Chemistry Accounts
2016 | Journal article
EID:

2-s2.0-84975296913

Part of ISBN:

1432881X

Contributors: Fidelsky, V.; Butera, V.; Zaffran, J.; Toroker, M.C.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Towards more accurate prediction of activation energies for polyalcohol dehydrogenation on transition metal catalysts in water

Catalysis Science and Technology
2016 | Journal article
EID:

2-s2.0-84983503738

Part of ISBN:

20444761 20444753

Contributors: Zaffran, J.; Michel, C.; Delbecq, F.; Sautet, P.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Benchmarking Density Functional Theory Based Methods To Model NiOOH Material Properties: Hubbard and van der Waals Corrections vs Hybrid Functionals.

Journal of chemical theory and computation
2016-07 | Journal article
Contributors: Zaffran J; Caspary Toroker M
Source: Self-asserted source
Jeremie Zaffran via Europe PubMed Central
grade
Preferred source (of 2)‎

Metal-Oxygen Bond Ionicity as an Efficient Descriptor for Doped NiOOH Photocatalytic Activity.

Chemphyschem : a European journal of chemical physics and physical chemistry
2016-03 | Journal article
Contributors: Zaffran J; Toroker MC
Source: Self-asserted source
Jeremie Zaffran via Europe PubMed Central
grade
Preferred source (of 2)‎

Trade-Off between Accuracy and Universality in Linear Energy Relations for Alcohol Dehydrogenation on Transition Metals

Journal of Physical Chemistry C
2015 | Journal article
EID:

2-s2.0-84931291837

Part of ISBN:

19327455 19327447

Contributors: Zaffran, J.; Michel, C.; Delbecq, F.; Sautet, P.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Linear energy relations as predictive tools for polyalcohol catalytic reactivity

ACS Catalysis
2014 | Journal article
EID:

2-s2.0-84893854914

Part of ISBN:

21555435

Contributors: Zaffran, J.; Michel, C.; Auneau, F.; Delbecq, F.; Sautet, P.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Role of water in metal catalyst performance for ketone hydrogenation: a joint experimental and theoretical study on levulinic acid conversion into gamma-valerolactone.

Chemical communications (Cambridge, England)
2014-10 | Journal article
Contributors: Michel C; Zaffran J; Ruppert AM; Matras-Michalska J; Jędrzejczyk M; Grams J; Sautet P
Source: Self-asserted source
Jeremie Zaffran via Europe PubMed Central
grade
Preferred source (of 2)‎

Simulation and visualization of nanodiamond and nanographite

Computer Physics Communications
2011 | Journal article
EID:

2-s2.0-79958108093

Part of ISBN:

00104655

Contributors: Adler, J.; Zaffran, J.; Silverman, A.; Sorkin, A.; Cohen, O.; Kalish, R.
Source: Self-asserted source
Jeremie Zaffran via Scopus - Elsevier

Phonon Modes in Si-Ge Nano-Structures for Hot Carrier Solar Cells

23rd European Photovoltaic Solar Energy Conference and Exhibition
2008 | Conference paper
Contributors: Jeremie Zaffran
Source: Self-asserted source
Jeremie Zaffran

Peer review (6 reviews for 2 publications/grants)

Review activity for ACS catalysis. (5)
Review activity for Nature Catalysis. (1)