Etienne GINDENSPERGER - Publications
Orcid: https://orcid.org/0000-0002-0720-5792
Google Scholar: https://scholar.google.fr/citations?user=TwTVv9cAAAAJ
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42. Excited-state dynamics of [Mn(im)(CO)3(phen)]+: PhotoCORM, catalyst, luminescent probe? M. Fumanal, C. Daniel and E. Gindensperger J. Chem. Phys. 154, 154102 (2021) |
41. Vibrational coherence and quantum yield of retinal-chromophore-inspired molecular switches M. Gueye, M. Paolino, E. Gindensperger, S. Haacke, M. Olivucci and J. Léonard Faraday Discuss. 221, 299-321 (2020) |
40. Strong Influence of Decoherence Corrections and Momentum Rescaling in Surface Hopping Dynamics of Transition Metal Complexes F. Plasser, S. Mai, M. Fumanal, E. Gindensperger, C. Daniel, L. Gonzalez J. Chem. Theory Comput. 15, 5031-5045 (2019) |
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39. Excited State Reactivity of [Mn(im)(CO)3(phen)]+: a Structural Exploration M. Fumanal,Y. Harabuchi, E. Gindensperger, S. Maeda and C. Daniel J. Comput. Chem. 40, 72-81 (2019) |
38. Ultrafast Intersystem Crossing vs. Internal Conversion in α-diimine Transition Metal Complexes: Quantum Evidence M. Fumanal, E. Gindensperger and C. Daniel J. Phys. Chem. Lett. 9, 5189-5195 (2018) |
37. Spin-Vibronic Mechanism for Intersystem Crossing T.J. Penfold, E. Gindensperger, C. Daniel and C.M. Marian Chem. Rev. 118, 6975-7025 (2018) |
36. Interstate vibronic coupling constants between electronic excited states for complex molecules M. Fumanal, F. Plasser, S. Mai, C. Daniel and E. Gindensperger J. Chem. Phys. 148, 124119 (2018) |
35. Ligand substitution and conformational effects on the ultrafast luminescent decay of [Re(CO)3(phen)(L)]+(L= imidazole, pyridine): non-adiabatic quantum dynamics M. Fumanal, E. Gindensperger and C. Daniel Phys. Chem. Chem. Phys. 20, 1134-1141 (2018) |
34. Ultrafast Excited-State Decays in [Re(CO)3(N, N)(L)]n+: Nonadiabatic Quantum Dynamics M. Fumanal, E. Gindensperger and C. Daniel J. Chem. Theory Comput. 13, 1293-1306 (2017) & J. Chem. Theory Comput. 13, 3952-3953 (2017) |
33. Exploring the Mechanism of Ultrafast Intersystem Crossing in Rhenium (I) Carbonyl Bipyridine Halide Complexes: Key Vibrational Modes and Spin–Vibronic Quantum Dynamics Y. Harabuchi, J. Eng, E. Gindensperger, T. Taketsugu, S. Maeda and C. Daniel J. Chem. Theory Comput. 12, 2335-2345 (2016) |
32. On the Directionality of Double Bond Photoisomerization Dynamics Induced by a Single Stereogenic Center G. Marchand, J. Eng, I. Schapiro, A. Valentini, L. M. Frutos, E. Pieri, M. Olivucci, J. Léonard and E. Gindensperger J. Phys. Chem. Lett. 6, 599-604 (2015) |
31. Spin-Vibronic Quantum Dynamics for Ultrafast Excited-State Processes J. Eng, C. Gourlaouen, E. Gindensperger and C. Daniel Account Chem. Res. 48, 809-817 (2015) |
30. Intramolecular Nuclear Flux Densities I. Barth, C. Daniel, E. Gindensperger, J. Manz, J. F. Pérez-Torres, A. Schild, C. Stemmle, D. Sulzer and Y. Yang In Advances in Multi-Photon Processes and Spectroscopy, S. H. Lin, A. A. Villaeys, Y. Fujimura, Eds. Vol. 22, 59-109 (2015) |
29. Ultrafast Photoisomerization of Chiral Biomimetic Molecular Switches M. Gueye, S. Haacke, S. Fusi, M. Olivucci, E. Gindensperger and J. Léonard In Ultrafast Phenomena XIX , Springer Proceedings in Physics Vol. 162, 517-520 (2014) |
28. Quantum Chemical Interpretation of Ultrafast Luminescence Decay and Intersystem Crossings in Rhenium(I) Carbonyl Bipyridine Complexes C. Gourlaouen, J. Eng, M. Otsuka, E. Gindensperger and C. Daniel J. Chem. Theory Comput. 11, 99-110 (2014) |
27. Spectroscopic trends in a series of Re(I) α-diimine complexes as a function of the antenna/photoisomerizable ligands: a TD-DFT and MS-CASPT2 study M. Kayanuma, C. Daniel and E. Gindensperger Can. J. Chem. 92, 979-986 (2014) |
26. Spin-Orbit Treatment of UV-Vis Absorption Spectra and Photophysics of Rhenium(I) Carbonyl-Bipyridine Complexes: MS-CASPT2 and TD-DFT Analysis R. Heydova, E. Gindensperger, R. Romano, J. Sykora, A. Vlcek, S. Zalis and C. Daniel J. Phys. Chem. A 116, 11319 (2012) |
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25. Efficient computation of adiabatic electronic populations in multi-mode vibronic systems: Theory, implementation and application B. Nikoobakht, H. Köppel, E. Gindensperger and L.S. Cederbaum J. Chem. Phys. 137, 114110 (2012) | |
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24. Inorganic Photoisomerization: the case study of Rhenium(I) complexes M. Kayanuma, E. Gindensperger and C. Daniel Dalton Trans. 41, 13191 (2012) | |
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23. Quantum Dynamics through Conical Intersections: Combining Effective Modes and Quadratic Couplings A. Vibók, A. Csehi, E. Gindensperger, H. Köppel and G.J. Halász J. Phys. Chem. A. 116, 2629 (2012) | |
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22. Efficient computation of adiabatic populations in multi-mode Jahn-Teller systems through the use of effective vibrational mode B. Nikoobakht, H. Köppel, E. Gindensperger and L.S. Cederbaum J. Chem. Phys. 135, 174110 (2011) | |
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21. Short-Time Dynamics Through Conical Intersections in Macrosystems: Quadratic Coupling Extension G.J. Halász, A. Papp, E. Gindensperger, H. Köppel and A. Vibók Advances in the Theory of Quantum Systems in Chemistry and Physics, Series: Progress in Theoretical Chemistry and Physics 22, 285 (Springer, 2011) | |
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20. Photophyics of isomerizable Re(I) complexes: A theorethical analysis M. Kayanuma, H. Köppel, C. Daniel and E. Gindensperger Coord. Chem. Rev. 255, 2693 (2011) | |
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19. Conical intersections coupled to an environment I. Burghardt, K.H. Hughes, H. Tamura, E. Gindensperger, H. Köppel and L.S. Cederbaum In Conical Intersections: Theory, Computation and Experiment, H. Köppel, D. R. Yarkony and W. Domcke, Eds. (Advanced Series in Physical Chemistry - Vol. 17, World Scientific, Singapore , 2011), 301 |
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18. Mechanism of visible-light photoisomerization of a rhenium(I) carbonyl-diimine complex E. Gindensperger, H. Köppel and C. Daniel Chem. Commun. 46, 8225 (2010) | |
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17. Ab initio study of the electronic singlet excited-state properties of tryptophan in the gas phase: The role of alanyl side-chain conformations E. Gindensperger, A. Haegy, C. Daniel and R. Marquardt Chem. Phys. 374, 104 (2010) | |
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16. Multi-Mode Jahn-Teller and Pseudo-Jahn-Teller Effects in Benzenoid Cations S. Faraji, E. Gindensperger and H. Köppel In The Jahn-Teller Effect: Fundamentals and Implications for Physics and Chemistry, H. Köppel, D. R. Yarkony and H. Barentzen, Eds. (Heidelberg, Springer, Series in Chemical Physics, Vol. 97, XXI, (2010)) 239-276 |
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15. Multidimensional Non-Adiabatic Dynamics G. A. Worth, H Köppel, E. Gindensperger and L. S. Cederbaum In Multidimensional Quantum Dynamics, H.-D. Meyer, F. Gatti and G. A. Worth, Eds. (Wiley-VCH, Weinheim, 2009) |
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14. Quantum dynamics
through conical intersections in macrosystems: Combining effective modes and
time-dependent Hartree M. Basler, E. Gindensperger, H.-D. Meyer and L. S. Cederbaum Chem. Phys. 347, 78 (2008) |
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13. Quantum dynamics in macrosystems with
several coupled electronic states: Hierarchy of effective Hamiltonians E. Gindensperger and L. S. Cederbaum J. Chem. Phys. 127, 124107 (2007) |
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12. Multi-state
vibronic interactions in the fluorobenzene radical cation: The importance of
quadratic coupling terms E. Gindensperger, I. Bâldea, J. Franz and H. Köppel Chem. Phys. 338, 207 (2007) |
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11. Hierarchy of effective
modes for the dynamics through conical intersections in macrosystems E. Gindensperger, H. Köppel and L. S. Cederbaum J. Chem. Phys. 126, 034107 (2007) |
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10. Ultrafast
excited-state dynamics at a conical intersection: the role of environmental
effects I. Burghardt, J. T. Hynes, E. Gindensperger and L. S. Cederbaum Phys. Scr. 73, C42 (2006) |
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9. Short-time dynamics
through conical intersections in macrosystems. II. Applications E. Gindensperger, I. Burghardt and L. S. Cederbaum J. Chem. Phys. 124, 144104 (2006). |
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8. Short-time dynamics
through conical intersections in macrosystems. I. Theory: Effective-mode
formulation E. Gindensperger, I. Burghardt and L. S. Cederbaum J. Chem. Phys. 124, 144103 (2006) |
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7. An effective Hamiltonian
for the short-time dynamics at a conical intersection I. Burghardt, E. Gindensperger and L. S. Cederbaum Mol. Phys., 104, 1081 (2006) |
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6. Short-time dynamics
through conical intersections in macrosystems L. S. Cederbaum, E. Gindensperger and I. Burghardt Phys. Rev. Lett. 94, 113003 (2005) |
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5. Combining fixed- and
moving-grid methods to study direct dissociation processes involving
nonadiabatic transitions E. Gindensperger, C. Meier, J. A. Beswick and G. Parlant J. Chem. Phys. 123, 214107 (2005) |
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4. Hybrid Quantum/Classical dynamics using Bohmian trajectories E. Gindensperger, C. Meier and J. A. Beswick Adv. Quantum Chem. 47, 399 (2004) |
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3. Quantum-classical
description of rotational diffractive scattering using Bohmian
trajectories: Comparison with full quantum wave packet E. Gindensperger, C. Meier, J. A. Beswick and M.-C. Heitz J. Chem. Phys. 116, 10051 (2002). |
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2. Quantum-classical dynamics
including continuum states using quantum trajectories E. Gindensperger, C. Meier and J. A. Beswick J. Chem. Phys. 116, 8 (2002). |
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1. Mixing quantum and classical
dynamics using Bohmian trajectories E. Gindensperger, C. Meier and J. A. Beswick J. Chem. Phys. 113, 9369 (2000). |
