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Fabien Gatti

Observed names: Dr. Fabien Gatti, F Gatti, F. Gatti, FABIEN GATTI, Fabien, Gatti, Gatti Fabien, Gatti, F, Gatti, F., Gatti, Fabien
Observed institutions: Université Paris-Sud, École Nationale Supérieure de Chimie de Montpellier, Centre National de la Recherche Scientifique, Université de Bourgogne, Dalian Institute of Chemical Physics, Xiamen University, Chinese Academy of Sciences, Université de Montpellier, Queen's University, Heidelberg University, Université Paris-Saclay, Laboratoire de Chimie Théorique, Institut Charles Gerhardt Montpellier, Institut des Sciences Moléculaires d'Orsay, Laboratoire Interdisciplinaire Carnot de Bourgogne, Institut Parisien de Chimie Moléculaire, Collaborative Innovation Center of Chemistry for Energy Materials, Université Montpellier 1, Université Montpellier 2, State Key Laboratory of Molecular Reaction Dynamics, Université Bourgogne Europe
ORCID: 0000-0002-5928-7427
Observed ORCIDs: 0000-0002-5928-7427, 0000-0002-6634-8013
OpenAlex ID: A5048151267
Multidimensional Quantum Dynamics: MCTDH Theory and Applications
2009 · Meyer, Hans-Dieter, Gatti, Fabien, et al. · Wiley eBooks · 826
Full dimensional (15-dimensional) quantum-dynamical simulation of the protonated water dimer. II. Infrared spectrum and vibrational dynamics
2007 · Oriol Vendrell, Fabien Gatti, et al. · The Journal of Chemical Physics · 247
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Calculation and selective population of vibrational levels with the Multiconfiguration Time-Dependent Hartree (MCTDH) algorithm
2006 · Hans-Dieter Meyer, Frédéric Le Quéré, et al. · Chemical Physics · 244
Dynamics and Infrared Spectroscopy of the Protonated Water Dimer
2007 · Oriol Vendrell, Fabien Gatti, et al. · Angewandte Chemie International Edition · 208
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Exact and constrained kinetic energy operators for polyatomic molecules: The polyspherical approach
2009 · Fabien Gatti, Christophe Iung · Physics Reports · 189
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Full-dimensional (15-dimensional) quantum-dynamical simulation of the protonated water dimer. I. Hamiltonian setup and analysis of the ground vibrational state
2007 · Oriol Vendrell, Fabien Gatti, et al. · The Journal of Chemical Physics · 170
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Vector parametrization of the N-atom problem in quantum mechanics. I. Jacobi vectors
1998 · Fabien Gatti, Christophe Iung, et al. · The Journal of Chemical Physics · 169
Computation of vibrational energy levels and eigenstates of fluoroform using the multiconfiguration time-dependent Hartree method
2008 · Loïc Joubert Doriol, Fabien Gatti, et al. · The Journal of Chemical Physics · 139
Determination of a flexible (12D) water dimer potential via direct inversion of spectroscopic data
2002 · Claude Leforestier, Fabien Gatti, et al. · The Journal of Chemical Physics · 135
Theoretical studies of the tunneling splitting of malonaldehyde using the multiconfiguration time-dependent Hartree approach
2011 · Markus Schröder, Fabien Gatti, et al. · The Journal of Chemical Physics · 121
A study of the mode-selective trans–cis isomerization in HONO using ab initio methodology
2004 · Falk Richter, Majdi Hochlaf, et al. · The Journal of Chemical Physics · 107
Full dimensional (15 dimensional) quantum-dynamical simulation of the protonated water-dimer IV: Isotope effects in the infrared spectra of D(D2O)2+, H(D2O)2+, and D(H2O)2+ isotopologues
2009 · Oriol Vendrell, Fabien Gatti, et al. · The Journal of Chemical Physics · 106
Full dimensional (15-dimensional) quantum-dynamical simulation of the protonated water-dimer III: Mixed Jacobi-valence parametrization and benchmark results for the zero point energy, vibrationally excited states, and infrared spectrum
2009 · Oriol Vendrell, Michael Brill, et al. · The Journal of Chemical Physics · 103
A general expression of the exact kinetic energy operator in polyspherical coordinates
2001 · Fabien Gatti, Claudio Muñoz, et al. · The Journal of Chemical Physics · 89
Strong Isotope Effects in the Infrared Spectrum of the Zundel Cation
2008 · Oriol Vendrell, Fabien Gatti, et al. · Angewandte Chemie International Edition · 87
Automatic computer procedure for generating exact and analytical kinetic energy operators based on the polyspherical approach
2012 · Mamadou Ndong, Loïc Joubert-Doriol, et al. · The Journal of Chemical Physics · 76
Fully coupled 6D calculations of the ammonia vibration-inversion-tunneling states with a split Hamiltonian pseudospectral approach
1999 · Fabien Gatti, Christophe Iung, et al. · The Journal of Chemical Physics · 76
Molecular Quantum Dynamics: From Theory to Applications
2014 · Fabien Gatti · Physical chemistry in action · 75
Vector parametrization of the N-atom problem in quantum mechanics. II. Coupled-angular-momentum spectral representations for four-atom systems
1998 · Fabien Gatti, Christophe Iung, et al. · The Journal of Chemical Physics · 75
Quantum dynamics of dissociative chemisorption of CH4 on Ni(111): Influence of the bending vibration
2010 · G. P. Krishnamohan, R. A. Olsen, et al. · The Journal of Chemical Physics · 70
Quantum-Mechanical Description of Rigidly or Adiabatically Constrained Molecular Systems
1997 · Fabien Gatti, Yves Justum, et al. · Journal of Molecular Spectroscopy · 70
Rotational excitation cross sections of para-H2+para-H2 collisions. A full-dimensional wave-packet propagation study using an exact form of the kinetic energy
2005 · Fabien Gatti, Frank Otto, et al. · The Journal of Chemical Physics · 69
Applications of Quantum Dynamics in Chemistry
2017 · Fabien Gatti, Benjamin Lasorne, et al. · Lecture notes in chemistry · 68
Time-dependent wave packet study on trans-cis isomerization of HONO
2004 · Falk Richter, Pavel Rosmus, et al. · The Journal of Chemical Physics · 59
The coupling of the hydrated proton to its first solvation shell
2022 · Markus Schröder, Fabien Gatti, et al. · Nature Communications · 58
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Works count: 216
Citation count: 5,925
H-index: 40
I10-index: 107
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