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Profil

Abdul Rahman ALLOUCHE
Nom:Name:ALLOUCHE Abdul Rahman
Position:Position:Enseignant-chercheur
Mel:Mail:abdul-rahman.allouche[at]univ-lyon1.fr
Equipe:Team:Physicochimie théorique
Bureau(x):Office(s):BRILLOUIN / 2ème / 12-015a
Tél(s):Phone(s):0787099194
Google Scholar ORCID ResearchGate Site web LinkedIn
19 publications à l'ILM ces 5 dernières années. 19 publications at ILM in the last 5 years. Voir les 69 publications des 15 dernières années. See 69 publications from the last 15 years.

157 publication(s) affichée(s) 157 publication(s) shown
Efficient Exploration of High-Dimensional Configuration Spaces for the Generation of Chemical Datasets BIB HAL DOI
Efficient Exploration of High-Dimensional Configuration Spaces for the Generation of Chemical Datasets DOI BIB HAL
Xuewen Xiao, Abdul-Rahman Allouche, Emmanuel Dartois, Frederic Magoules, Daniel Peláez
Journal of Chemical Information and Modeling, vol. 65, p. 11094-11106, (2025)
A Portable Data Set for Borophene Growth Modeling with Reactive Neural Network Potentials BIB HAL DOI
A Portable Data Set for Borophene Growth Modeling with Reactive Neural Network Potentials DOI BIB HAL
Colin Bousige, Anouar-Akacha Delenda, Abdul-Rahman Allouche, Pierre Mignon
Journal of Physical Chemistry C, vol. 129, p. 18760-18771, (2025)
Neural Network Atomistic Potential for Pyrophyllite Clay Simulations BIB HAL DOI
Neural Network Atomistic Potential for Pyrophyllite Clay Simulations DOI BIB HAL
Chloe Sanz, Abdul-Rahman Allouche, Colin Bousige, Pierre Mignon
Journal of Physical Chemistry A, vol. 129, p. 3567-3577, (2025)
Machine Learning and Molecular Dynamics – Application to borophene on metallic substrate BIB HAL
Machine Learning and Molecular Dynamics – Application to borophene on metallic substrate BIB HAL
Pierre Mignon, Abdul-Rahman Allouche, Colin Bousige
(2024)
High-dimensional neural network potential for borophene on metallic surfaces BIB HAL
High-dimensional neural network potential for borophene on metallic surfaces BIB HAL
Pierre Mignon, Abdul-Rahman Allouche, Colin Bousige
(2024)
High-dimensional neural network potential for borophene on metallic surfaces BIB HAL
High-dimensional neural network potential for borophene on metallic surfaces BIB HAL
Colin Bousige, Pierre Mignon, Abdul-Rahman Allouche, Neil Richard Innis
(2024)
Theoretical study of the Ca + − He ionic system with spin–orbit coupling BIB HAL DOI
Theoretical study of the Ca + − He ionic system with spin–orbit coupling DOI BIB HAL
L Yandjah, O Smida, K. Alioua, Abdul-Rahman Allouche, N Lamoudi, M Bouazza
Physica Scripta, vol. 99, p. 035410, (2024)
Conformational preferences of the flexible galactofuranose sugar in gas-phase BIB HAL DOI
Conformational preferences of the flexible galactofuranose sugar in gas-phase DOI BIB HAL
Oznur Yeni, Abdul-Rahman Allouche, Laurent Legentil, Vincent Ferrières, Isabelle Compagnon
Physical Chemistry Chemical Physics, vol. 25, p. 20373-20380, (2023)
Neural Network Approach for a Rapid Prediction of Metal-Supported Borophene Properties BIB HAL DOI
Neural Network Approach for a Rapid Prediction of Metal-Supported Borophene Properties DOI BIB HAL
Pierre Mignon, Abdul-Rahman Allouche, Neil Richard Innis, Colin Bousige
Journal of the American Chemical Society, vol. 145, p. 27857-27866, (2023)
Tight Binding and Density Functional Theory of Tailoring Electronic Properties in Al1−xInxN/AlN/GaN High Electron Mobility Transistors (HEMTs) BIB HAL DOI
Tight Binding and Density Functional Theory of Tailoring Electronic Properties in Al1−xInxN/AlN/GaN High Electron Mobility Transistors (HEMTs) DOI BIB HAL
Meziani Abdelhakim, Abdul-Rahman Allouche, Telia Azzedine, Hilmi Unlu
Array, vol. 144, p. 669-707, (2022)
O -Acetylated sugars in the gas phase: stability, migration, positional isomers and conformation BIB HAL DOI
O -Acetylated sugars in the gas phase: stability, migration, positional isomers and conformation DOI BIB HAL
Oznur Yeni, Amira Mounya Gharbi, Stéphane Chambert, Jean Rouillon, Abdul-Rahman Allouche, Baptiste Schindler, Isabelle Compagnon
Physical Chemistry Chemical Physics, vol. 24, p. 1016-1022, (2022)
On-the-fly investigation of XUV excited large molecular ions using a high harmonic generation light source BIB HAL DOI
On-the-fly investigation of XUV excited large molecular ions using a high harmonic generation light source DOI BIB HAL
Marius Hervé, Alexie Boyer, Richard Brédy, Abdul-Rahman Allouche, Isabelle Compagnon, Franck Lépine
Scientific Reports, vol. 12, p. 13191, (2022)
Controlled ultrafast ππ*-πσ* dynamics in tryptophan-based peptides with tailored micro-environment BIB HAL DOI
Controlled ultrafast ππ*-πσ* dynamics in tryptophan-based peptides with tailored micro-environment DOI BIB HAL
Marius Hervé, Alexie Boyer, Richard Brédy, Isabelle Compagnon, Abdul-Rahman Allouche, Franck Lépine
Communications Chemistry, vol. 4, (2021)
Spectroscopic characterization and binding interaction of heavy metal onto the surface receptor of the azobenzene: DFT and experimental approach BIB HAL DOI
Spectroscopic characterization and binding interaction of heavy metal onto the surface receptor of the azobenzene: DFT and experimental approach DOI BIB HAL
Marwa Chaabene, Soumaya Agren, Jamal El Haskouri, Abdul-Rahman Allouche, Lahcini Mohamed, Rafik Ben Chaâbane, Mohamed Hassen V Baouab
Journal of Molecular Structure, vol. 1244, p. 130962, (2021)
Insights into theoretical detection of CO2, NO, CO, O2, and O3 gases molecules using Zinc phthalocyanine with peripheral mono and tetra quinoleinoxy substituents: Molecular geometries, Electronic properties, and Vibrational analysis BIB HAL DOI
Insights into theoretical detection of CO2, NO, CO, O2, and O3 gases molecules using Zinc phthalocyanine with peripheral mono and tetra quinoleinoxy substituents: Molecular geometries, Electronic properties, and Vibrational analysis DOI BIB HAL
Marwa Chaabene, Bouzid Gassoumi, Raoudha Soury, Houcine Ghalla, Mahjoub Jabli, Rafik Ben Chaâbane, Abdul-Rahman Allouche
Chemical Physics, vol. 547, p. 111198, (2021)
Ultrafast XUV-induced Dynamics in Gas-phase Complex Molecules BIB HAL
Ultrafast XUV-induced Dynamics in Gas-phase Complex Molecules BIB HAL
Marius Hervé, V. Despré, V. Loriot, Alexie Boyer, Richard Brédy, Eric Constant, Abdul-Rahman Allouche, Isabelle Compagnon, Alexander I. Kuleff, Franck Lépine
(2021)
Infrared spectra of neutral polycyclic aromatic hydrocarbons based on machine learning potential energy surface and dipole mapping BIB HAL DOI
Infrared spectra of neutral polycyclic aromatic hydrocarbons based on machine learning potential energy surface and dipole mapping DOI BIB HAL
Gaétan Laurens, Malalatiana Rabary, Julien Lam, Daniel Peláez, Abdul-Rahman Allouche
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, vol. 140, p. 66, (2021)
Controlled Ultrafast Charge Transfer Dynamics in Peptides with Tailored Micro-environment BIB HAL
Controlled Ultrafast Charge Transfer Dynamics in Peptides with Tailored Micro-environment BIB HAL
Marius Hervé, Alexie Boyer, Richard Brédy, Isabelle Compagnon, Abdul-Rahman Allouche, Franck Lépine
(2021)
Non long‐range corrected density functionals incorrectly describe the intensity of the C-H stretching band in polycyclic aromatic hydrocarbons BIB HAL DOI
Non long‐range corrected density functionals incorrectly describe the intensity of the C-H stretching band in polycyclic aromatic hydrocarbons DOI BIB HAL
Hugo Geindre, Abdul-Rahman Allouche, Daniel Peláez
Journal of Computational Chemistry, (2021)
Ab-initio study of the ground and low-lying excited states including the spin-orbit effect of RbBa molecule and laser cooling feasibility BIB HAL DOI
Ab-initio study of the ground and low-lying excited states including the spin-orbit effect of RbBa molecule and laser cooling feasibility DOI BIB HAL
Hela Ladjimi, Wissem Zrafi, Abdul-Rahman Allouche, Hamid Berriche
Journal of Quantitative Spectroscopy and Radiative Transfer, vol. 252, p. 107069, (2020)
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