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A pair potential modeling study of F 3 − in neon matrices

Frederik Bader , Jean Christophe Tremblay , Beate Paulus
Physical Chemistry Chemical Physics, 2021, 23 (2), pp.886-899. ⟨10.1039/D0CP05031H⟩
Article dans une revue hal-04460949v1

Attosecond Charge Migration Can Break Electron Symmetry While Conserving Nuclear Symmetry

Dietrich Haase , Jörn Manz , Jean Christophe Tremblay
Journal of Physical Chemistry A, 2020, 124 (17), pp.3329-3334. ⟨10.1021/acs.jpca.0c00404⟩
Article dans une revue hal-03331356v1

Attosecond Control of Restoration of Electronic Structure Symmetry

Chunmei Liu , Jörn Manz , Kenji Ohmori , Christian Sommer , Nobuyuki Takei , et al.
Physical Review Letters, 2018, 121 (17), ⟨10.1103/PhysRevLett.121.173201⟩
Article dans une revue hal-02267342v1

Mechanistic Insights into Electronic Current Flow through Quinone Devices

Lawrence Conrad , Isaac Alcón , Jean Christophe Tremblay , Beate Paulus
Nanomaterials, 2023, 13 (24), pp.3085. ⟨10.3390/nano13243085⟩
Article dans une revue hal-04460861v1

Imaging Valence Electron Dynamics during Surface Diffusion

Kai Töpfer , Gopal Dixit , Jean Christophe Tremblay
Journal of Physical Chemistry C, 2021, 125 (34), pp.19032-19039. ⟨10.1021/acs.jpcc.1c06467⟩
Article dans une revue hal-03631791v1

Stochastic wave packet approach to nonadiabatic scattering of diatomic molecules from metals

T. Serwatka , Jean Christophe Tremblay
Journal of Chemical Physics, 2019, 150 (18), pp.184105. ⟨10.1063/1.5092698⟩
Article dans une revue hal-02267345v1

Impact of Structure, Coupling Scheme, and State of Interest on the Energy Transfer in CP29

S. Petry , Jean Christophe Tremblay , J. Götze
Journal of Physical Chemistry B, 2023, 127 (33), pp.7207-7219. ⟨10.1021/acs.jpcb.3c01012⟩
Article dans une revue hal-04460855v1

Theoretical investigations of the interaction between diatomic molecules and coinage metal atoms

Y. Qawasmeh , K. Töpfer , T. Serwatka , Jean Christophe Tremblay , B. Paulus
Molecular Physics, 2021, 119 (9), pp.e1892224. ⟨10.1080/00268976.2021.1892224⟩
Article dans une revue hal-04460960v1

Ethical Artificial Intelligence in Chemical Research and Development: A Dual Advantage for Sustainability

Erik Hermann , Gunter Hermann , Jean-Christophe Tremblay
Science and Engineering Ethics, 2021, 27 (4), pp.45. ⟨10.1007/s11948-021-00325-6⟩
Article dans une revue hal-04460911v1

Electronic structure, optical properties, and electron dynamics in organic dye-sensitized TiO2 interfaces by local hybrid density functionals

D. Gemeri , Jean Christophe Tremblay , M. Pastore , H. Bahmann
Chemical Physics, 2022, 559, pp.111521. ⟨10.1016/j.chemphys.2022.111521⟩
Article dans une revue hal-03631783v1

Probing Electronic Fluxes via Time-Resolved X-Ray Scattering

Gunter Hermann , Vincent Pohl , Gopal Dixit , Jean Christophe Tremblay
Physical Review Letters, 2020, 124 (1), pp.013002. ⟨10.1103/PhysRevLett.124.013002⟩
Article dans une revue hal-03603429v1

The Peculiar Interaction of Trifluoride Anions with Cryogenic Rare Gas Matrices

Frederik Bader , Sebastian Riedel , Helmut Beckers , Carsten Müller , Jean Christophe Tremblay , et al.
Journal of Physical Chemistry A, 2021, 125 (28), pp.6221-6227. ⟨10.1021/acs.jpca.1c04711⟩
Article dans une revue hal-03331069v1

Understanding Charge Transport in Triarylmethyl-Based Spintronic Nanodevices

Jingjing Shao , Isaac Alcón , Beate Paulus , Jean Christophe Tremblay
Journal of Physical Chemistry C, 2021, 125 (46), pp.25624-25633. ⟨10.1021/acs.jpcc.1c06352⟩
Article dans une revue hal-03631790v1

Multidimensional stochastic dissipative quantum dynamics using a Lindblad operator

Souvik Mandal , Fabien Gatti , Oussama Bindech , Roberto Marquardt , Jean-Christophe Tremblay
Journal of Chemical Physics, 2022, 156 (9), pp.094109. ⟨10.1063/5.0079735⟩
Article dans une revue hal-03774090v1

Imaging Time-Dependent Electronic Currents through a Graphene-Based Nanojunction

Vincent Pohl , Lukas Eugen Marsoner Steinkasserer , Jean Christophe Tremblay
Journal of Physical Chemistry Letters, 2019, pp.5387-5394. ⟨10.1021/acs.jpclett.9b01732⟩
Article dans une revue hal-02283351v1

Conformational control over π-conjugated electron pairing in 1D organic polymers

Isaac Alcón , Jingjing Shao , Jean Christophe Tremblay , Beate Paulus
RSC Advances, 2021, 11 (33), pp.20498-20506. ⟨10.1039/D1RA03187B⟩
Article dans une revue hal-04460953v1

Laser-Induced Electron Symmetry Restoration in Oriented Molecules Made Simple

Chunmei Liu , Jörn Manz , Jean Christophe Tremblay
Journal of Physical Chemistry Letters, 2021, 12 (18), pp.4421-4427. ⟨10.1021/acs.jpclett.1c00645⟩
Article dans une revue hal-03331085v1

Atomistic Simulations of Laser-Controlled Exciton Transfer and Stabilization in Symmetric Double Quantum Dots

Pascal Krause , Jean Christophe Tremblay , Annika Bande
Journal of Physical Chemistry A, 2021, 125 (22), pp.4793-4804. ⟨10.1021/acs.jpca.1c02501⟩
Article dans une revue hal-03331087v1

From Molecular Symmetry Breaking to Symmetry Restoration by Attosecond Quantum Control

Chunmei Liu , Jörn Manz , Jean Christophe Tremblay
Yamanouchi, Kaoru and Martin, Philippe and Sentis, Marc and Ruxin, Li and Normand, Didier. Progress in Ultrafast Intense Laser Science XIV, 118, Springer International Publishing, pp.117--141, 2018, 978-3-030-03785-7 978-3-030-03786-4. ⟨10.1007/978-3-030-03786-4_7⟩
Chapitre d'ouvrage hal-03603448v1

Probing the effect of molecular structure saddling on ultrafast charge migration via time-resolved x-ray diffraction

Sucharita Giri , Jean Christophe Tremblay , Gopal Dixit
Physical Review A, 2022, 106 (3), pp.033120. ⟨10.1103/PhysRevA.106.033120⟩
Article dans une revue hal-04460885v1

Theoretical modeling of molecules in weakly interacting environments: trifluoride anions in argon

Frederik Bader , Jean Christophe Tremblay , Beate Paulus
Physical Chemistry Chemical Physics, 2022, 24 (6), pp.3555-3567. ⟨10.1039/D1CP02338A⟩
Article dans une revue hal-04460896v1

Proton-Coupled Electron-Transfer Dynamics of Water Oxidation at N-Doped Graphene Oxides

Fabian Weber , Jean Christophe Tremblay , Annika Bande
Journal of Physical Chemistry C, 2020, 124 (49), pp.26688-26698. ⟨10.1021/acs.jpcc.0c08937⟩
Article dans une revue hal-03331338v1

Probing Electronic Fluxes via Time-Resolved X-ray Scattering

Gunter Hermann , Vincent Pohl , Gopal Dixit , Jean Christophe Tremblay
2019
Pré-publication, Document de travail hal-02267300v1

Dipole-Induced Transition Orbitals: A Novel Tool for Investigating Optical Transitions in Extended Systems

Gunter Hermann , Lukas Eugen Marsoner Steinkasserer , Beate Paulus , Jean Christophe Tremblay
Journal of Physical Chemistry Letters, 2018, 9 (22), pp.6624-6630. ⟨10.1021/acs.jpclett.8b02253⟩
Article dans une revue hal-02267333v1

From Symmetry Breaking via Charge Migration to Symmetry Restoration in Electronic Ground and Excited States: Quantum Control on the Attosecond Time Scale

Chunmei Liu , Joern Manz , Jean Christophe Tremblay
Applied Sciences, 2019, 9 (5), pp.953. ⟨10.3390/app9050953⟩
Article dans une revue hal-02267348v1

Time-resolved diffraction: general discussion

Felix Allum , Kasra Amini , Michael Ashfold , Dipanshu Bansal , Raphael Berger , et al.
Faraday Discussions, 2021, 228, pp.161-190. ⟨10.1039/D1FD90023D⟩
Article dans une revue hal-04460900v1

Influence of Mesoionic Carbenes on Electro- and Photoactive Ru and Os Complexes: A Combined (Spectro-)Electrochemical, Photochemical, and Computational Study

Lisa Suntrup , Felix Stein , Gunter Hermann , Merlin Kleoff , Martin Kuss-Petermann , et al.
Inorganic Chemistry, 2018, 57 (21), pp.13973-13984. ⟨10.1021/acs.inorgchem.8b02551⟩
Article dans une revue hal-02267327v1

First-Principle Investigations of the Interaction between CO and O 2 with Group 11 Atoms on a Defect-Free MgO(001) Surface

Kai Töpfer , Jean Christophe Tremblay
Journal of Physical Chemistry A, 2018, 122 (8), pp.2307-2317. ⟨10.1021/acs.jpca.8b00647⟩
Article dans une revue hal-02267346v1

5 Is there a unique way of localizing molecular orbitals, and why not

Jean Christophe Tremblay
Simon Grabowsky. Complementary Bonding Analysis, De Gruyter, pp.113-128, 2021, De Gruyter STEM, 9783110660074. ⟨10.1515/9783110660074-005⟩
Chapitre d'ouvrage hal-03331337v1

Time-resolved imaging of correlation-driven charge migration in light-induced molecular magnets by X-ray scattering

Jean Christophe Tremblay , Vincent Pohl , Gunter Hermann , Gopal Dixit
Faraday Discussions, 2021, 228, pp.82-103. ⟨10.1039/D0FD00116C⟩
Article dans une revue hal-03331099v1