Abdulrahman ALLOUCHE

Publications

Chapitre d'ouvrage (1)

Tight Binding and Density Functional Theory of Tailoring Electronic Properties in Al1−xInxN/AlN/GaN High Electron Mobility Transistors (HEMTs) Meziani Abdelhakim,Abdul-Rahman Allouche,Telia Azzedine,Hilmi Unlu Progress in Nanoscale and Low-Dimensional Materials and Devices, 144, Springer International Publishing, pp.669-707, 2022, Topics in Applied Physics, 978-3-030-93459-0. ⟨10.1007/978-3-030-93460-6_24⟩ Chapitre d'ouvrage hal-04267855v1

Pré-publication, Document de travail (1)

iGVPT2 : an interface to computational chemistry packages for anharmonic corrections to vibrational frequencies Loïc Barnes,Baptiste Schindler,Isabelle Compagnon,Abdul-Rahman Allouche 2017 Pré-publication, Document de travail hal-01673961v1

Article dans une revue (146)

A Portable Data Set for Borophene Growth Modeling with Reactive Neural Network Potentials Colin Bousige,Anouar-Akacha Delenda,Abdul-Rahman Allouche,Pierre Mignon Journal of Physical Chemistry C, 2025, 129 (41), pp.18760-18771. ⟨10.1021/acs.jpcc.5c04912⟩ Article dans une revue hal-05318033v1
Neural Network Atomistic Potential for Pyrophyllite Clay Simulations Chloe Sanz,Abdul-Rahman Allouche,Colin Bousige,Pierre Mignon Journal of Physical Chemistry A, 2025, 129 (15), pp.3567-3577. ⟨10.1021/acs.jpca.5c00406⟩ Article dans une revue hal-05038937v1
Efficient Exploration of High-Dimensional Configuration Spaces for the Generation of Chemical Datasets Xuewen Xiao,Abdul-Rahman Allouche,Emmanuel Dartois,Frédéric Magoulès,Daniel Peláez Journal of Chemical Information and Modeling, 2025, 65 (20), pp.11094-11106. ⟨10.1021/acs.jcim.5c01286⟩ Article dans une revue hal-05492616v1
Theoretical study of the Ca + − He ionic system with spin–orbit coupling L Yandjah,O Smida,K Alioua,Abdul-Rahman Allouche,N Lamoudiet al. Physica Scripta, 2024, 99 (3), pp.035410. ⟨10.1088/1402-4896/ad22ca⟩ Article dans une revue hal-04499854v1
Neural Network Approach for a Rapid Prediction of Metal-Supported Borophene Properties Pierre Mignon,Abdul-Rahman Allouche,Neil Richard Innis,Colin Bousige Journal of the American Chemical Society, 2023, 145 (50), pp.27857-27866. ⟨10.1021/jacs.3c11549⟩ Article dans une revue hal-04342585v1
Conformational preferences of the flexible galactofuranose sugar in gas-phase Oznur Yeni,Abdul-Rahman Allouche,Laurent Legentil,Vincent Ferrières,Isabelle Compagnon Physical Chemistry Chemical Physics, 2023, 25 (30), pp.20373-20380. ⟨10.1039/d3cp01671d⟩ Article dans une revue hal-04189817v1
On-the-fly investigation of XUV excited large molecular ions using a high harmonic generation light source Marius Hervé,Alexie Boyer,Richard Brédy,Abdul-Rahman Allouche,Isabelle Compagnonet al. Scientific Reports, 2022, 12 (1), pp.13191. ⟨10.1038/s41598-022-17416-4⟩ Article dans une revue hal-03821724v1
O -Acetylated sugars in the gas phase: stability, migration, positional isomers and conformation Oznur Yeni,Amira Gharbi,Stéphane Chambert,Jean Rouillon,Abdul-Rahman Alloucheet al. Physical Chemistry Chemical Physics, 2022, 24 (2), pp.1016-1022. ⟨10.1039/D1CP04837F⟩ Article dans une revue hal-04619326v1
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 Marwa Chaabene,Bouzid Gassoumi,Raoudha Soury,Houcine Ghalla,Mahjoub Jabliet al. Chemical Physics, 2021, 547, pp.111198. ⟨10.1016/j.chemphys.2021.111198⟩ Article dans une revue hal-03251987v1
Controlled ultrafast ππ*-πσ* dynamics in tryptophan-based peptides with tailored micro-environment Marius Hervé,Alexie Boyer,Richard Brédy,Isabelle Compagnon,Abdul-Rahman Alloucheet al. Communications Chemistry, 2021, 4 (1), ⟨10.1038/s42004-021-00557-4⟩ Article dans une revue hal-03342205v1
Non long‐range corrected density functionals incorrectly describe the intensity of the C-H stretching band in polycyclic aromatic hydrocarbons Hugo Geindre,Abdul-Rahman Allouche,Daniel Peláez Journal of Computational Chemistry, 2021, ⟨10.1002/jcc.26520⟩ Article dans une revue hal-03183938v1
Infrared spectra of neutral polycyclic aromatic hydrocarbons based on machine learning potential energy surface and dipole mapping Gaétan Laurens,Malalatiana Rabary,Julien Lam,Daniel Peláez,Abdul-Rahman Allouche Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2021, 140 (6), pp.66. ⟨10.1007/s00214-021-02773-6⟩ Article dans une revue hal-03248387v1
Spectroscopic characterization and binding interaction of heavy metal onto the surface receptor of the azobenzene: DFT and experimental approach Marwa Chaabene,Soumaya Agren,Jamal El Haskouri,Abdul-Rahman Allouche,Lahcini Mohamedet al. Journal of Molecular Structure, 2021, 1244, pp.130962. ⟨10.1016/j.molstruc.2021.130962⟩ Article dans une revue hal-03411270v1
Combining Quantum Mechanics and Machine-Learning Calculations for Anharmonic Corrections to Vibrational Frequencies Julien Lam,Saleh Abdul-Al,Abdul-Rahman Allouche Journal of Chemical Theory and Computation, 2020, 16 (3), pp.1681-1689. ⟨10.1021/acs.jctc.9b00964⟩ Article dans une revue hal-02531529v1
Blue Highly Fluorescent Boranil Derived From Anil Ligand: Synthesis, Characterization, Experimental and Theoretical Evaluation of Solvent Effect on Structures and Photophysical Properties Soumaya Agren,Marwa Chaabene,Abdul-Rahman Allouche,Rafik Ben Chaâbane,Mohamed Lahcinieet al. Applied Organometallic Chemistry, 2020, 34 (9), pp.e5764. ⟨10.1002/aoc.5764⟩ Article dans une revue hal-03230000v1
Ab-initio study of the ground and low-lying excited states including the spin-orbit effect of RbBa molecule and laser cooling feasibility Hela Ladjimi,Wissem Zrafi,Abdul-Rahman Allouche,Hamid Berriche Journal of Quantitative Spectroscopy and Radiative Transfer, 2020, 252, pp.107069. ⟨10.1016/j.jqsrt.2020.107069⟩ Article dans une revue hal-02869458v1
Comparison of aluminum oxide empirical potentials from cluster to nanoparticle Gaétan Laurens,David Amans,Julien Lam,Abdul-Rahman Allouche Physical Review B, 2020, 101 (4), pp.045427. ⟨10.1103/PhysRevB.101.045427⟩ Article dans une revue hal-03229989v1
Ion spectroscopy of heterogeneous mixtures: IRMPD and DFT analysis of anomers and conformers of monosaccharides Loïc Barnes,Abdul-Rahman Allouche,Stéphane Chambert,Baptiste Schindler,Isabelle Compagnon International Journal of Mass Spectrometry, 2020, 447, pp.116235. ⟨10.1016/j.ijms.2019.116235⟩ Article dans une revue hal-02424436v1
Theoretical investigation of the pressure broadening D 1 and D 2 lines of cesium atoms colliding with ground-state helium atoms Moussaoui Abdelaziz,Alioua Kamel,Abdul-Rahman Allouche,Bouledroua Moncef Chinese Physics B, 2019, 28 (10), pp.103103. ⟨10.1088/1674-1056/ab4043⟩ Article dans une revue hal-02424433v1
Photo-dissociation of naphthalene dimer cations stored in a compact electrostatic ion storage ring Jérôme Bernard,Abdulaziz Al-Mogeeth,Abdul-Rahman Allouche,Lin Chen,Guillaume Montagneet al. The Journal of Chemical Physics, 2019, 150 (5), pp.054303. ⟨10.1063/1.5055939⟩ Article dans une revue hal-03011418v1
On-the-Fly Femtosecond Action Spectroscopy of Charged Cyanine Dyes: Electronic Structure versus Geometry Marius Hervé,Richard Bredy,Gabriel Karras,Bruno Concina,Jeffery Brownet al. Journal of Physical Chemistry Letters, 2019, 10 (9), pp.2300-2305. ⟨10.1021/acs.jpclett.9b00435⟩ Article dans une revue hal-02364934v1
Meso-tetrakis(3,4,5-trimethoxyphenyl)porphyrin derivatives: Synthesis, spectroscopic characterizations and adsorption of NO2 Raoudha Soury,Marwa Chaabéne,Mahjoub Jabli,Tawfik Saleh,Rafik Ben Chaâbaneet al. Chemical Engineering Journal, 2019, 375, pp.122005. ⟨10.1016/j.cej.2019.122005⟩ Article dans une revue istex hal-02363497v1
Effects of thiol ligands on the growth and stability of CdS nanoclusters Sabah Nasraoui,Ghada Attia,Naim Bel Haj Mohamed,Rafik Ben Chaâbane,Abdul-Rahman Allouche Journal of Molecular Structure, 2019, 1198, pp.126832. ⟨10.1016/j.molstruc.2019.07.079⟩ Article dans une revue istex hal-02364595v1
Ab initio calculations of electronic structure of the BaCs molecule: adiabatic potential energy curves, spectroscopic constants, spin–orbit effect and permanent and transition electric dipole moments H. Ladjimi,M. Farjallah,R. Mlika,Abdul-Rahman Allouche,H. Berriche Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2019, 138 (4), pp.56. ⟨10.1007/s00214-019-2443-0⟩ Article dans une revue hal-02424429v1
Spectroscopic diagnostic for the ring-size of carbohydrates in the gas phase: furanose and pyranose forms of GalNAc Baptiste Schindler,Laurent Legentil,Abdul-Rahman Allouche,Vincent Ferrières,Isabelle Compagnon Physical Chemistry Chemical Physics, 2019, 21 (23), pp.12460-12467. ⟨10.1039/c8cp04082f⟩ Article dans une revue hal-02150450v1
New zinc phthalocyanine derivatives for nitrogen dioxide sensors: A theoretical optoelectronic investigation M. Chaabene,B. Gassoumi,Pierre Mignon,R. Ben Chaabane,Abdul-Rahman Allouche Journal of Molecular Graphics and Modelling, 2019, 88, pp.174-182. ⟨10.1016/j.jmgm.2019.01.008⟩ Article dans une revue istex hal-02285865v1
Theoretical and experimental investigations of complexation with BF 3 .Et 2 O effects on electronic structures, energies and photophysical properties of Anil and tetraphenyl (hydroxyl) imidazol Marwa Chaabene,Soumaya Agren,Abdul-Rahman Allouche,Mohamed Lahcinie,Rafik Ben Chaabaneet al. Applied Organometallic Chemistry, 2019, 33 (11), pp.e5218. ⟨10.1002/aoc.5218⟩ Article dans une revue hal-02368405v1
Structural and electronic properties of wurtzite, zincblende and rocksalt Al 1 − x In x N ternary alloys at ambient and high pressure Abdelhakim Meziani,Lemia Semra,Azzedine Telia,Hilmi Ünlü,Abdul-Rahman Allouche Phase Transitions, 2018, 91 (12), pp.1232-1245. ⟨10.1080/01411594.2018.1527913⟩ Article dans une revue hal-03230527v1
Online Separation and Identification of Isomers Using Infrared Multiple Photon Dissociation Ion Spectroscopy Coupled to Liquid Chromatography: Application to the Analysis of Disaccharides Regio-Isomers and Monosaccharide Anomers Baptiste Schindler,Gabrielle Laloy-Borgna,Loic Barnes,Abdul-Rahman Allouche,Elodie Boujuet al. Analytical Chemistry, 2018, 90 (20), pp.11741-11745. ⟨10.1021/acs.analchem.8b02801⟩ Article dans une revue hal-01936856v1
Theoretical and experimental investigation on ligands-CdS clusters interactions: Influence of solvent S. Nasraoui,Brahim N. Ben,N. B. H. Mohamed,Chaabane R. Ben,Abdul-Rahman Allouche Journal of Molecular Structure, 2018, 1173, pp.894-902. ⟨10.1016/j.molstruc.2018.07.057⟩ Article dans une revue istex hal-02290280v1
MS/IR, a new MS-based hyphenated method for analysis of hexuronic acid epimers in glycosaminoglycans Baptiste Schindler,Gina Renois-Predelus,Nassiba Bagdadi,Sihem Melizi,Loïc Barneset al. Glycoconjugate Journal, 2017, 34 (3), pp.421 - 425. ⟨10.1007/s10719-016-9741-8⟩ Article dans une revue hal-01673956v1
Conformational preferences of protonated N -acetylated hexosamines probed by InfraRed Multiple Photon Dissociation (IRMPD) spectroscopy and ab initio calculations Loïc Barnes,Baptiste Schindler,Stéphane Chambert,Abdul-Rahman Allouche,Isabelle Compagnon International Journal of Mass Spectrometry, 2017, 421, pp.116 - 123. ⟨10.1016/j.ijms.2017.05.005⟩ Article dans une revue hal-01673951v1
Anomeric memory of the glycosidic bond upon fragmentation and its consequences for carbohydrate sequencing Baptiste Schindler,Loïc Barnes,Gina Renois,Christopher Gray,Stéphane Chambertet al. Nature Communications, 2017, 8 (1), pp.973. ⟨10.1038/s41467-017-01179-y⟩ Article dans une revue hal-01673946v1
Hydrogen-Induced Adsorption of Carbon Monoxide on the Gold Dimer Cation: A Joint Experimental and DFT Investigation Marin Vojkovic,Driss Rayane,Rodolphe Antoine,Michel Broyer,Abdul-Rahman Alloucheet al. Journal of Physical Chemistry A, 2017, 121 (23), pp.4404 - 4411. ⟨10.1021/acs.jpca.7b01564⟩ Article dans une revue hal-01673953v1
Theoretical study of HNCO formation from atomic nitrogen and carbon monoxide in the presence of water Pierre Mignon,Abdul-Rahman Allouche,Marie-Christine Bacchus-Montabonel Chemical Physics, 2017, 488-489, pp.28 - 35. ⟨10.1016/j.chemphys.2017.03.008⟩ Article dans une revue istex hal-01673957v1
IRMPD Spectroscopy Sheds New (Infrared) Light on the Sulfate Pattern of Carbohydrates Baptiste Schindler,Loïc Barnes,C. Gray,S. Chambert,L. Flitschet al. Journal of Physical Chemistry A, 2017, 121 (10), pp.2114-2120. ⟨10.1021/acs.jpca.6b11642⟩ Article dans une revue hal-01966732v1
Bottom-Up Elucidation of Glycosidic Bond Stereochemistry Christopher Gray,Baptiste Schindler,Lukasz G. Migas,Martina Pičmanová,Abdul-Rahman Alloucheet al. Analytical Chemistry, 2017, 89 (8), pp.4540 - 4549. ⟨10.1021/acs.analchem.6b04998⟩ Article dans une revue hal-01673962v1
Fragmentation dynamics of meso-tetraphenyl iron (III) porphyrin chloride dication under energy control B. Li,Abdul-Rahman Allouche,J. Bernard,R. Brédy,D. B. Qianet al. The Journal of Chemical Physics, 2017, 146 (12), ⟨10.1063/1.4978626⟩ Article dans une revue hal-01673964v1
Fast and accurate hybrid QM//MM approach for computing anharmonic corrections to vibrational frequencies Loïc Barnes,Baptiste Schindler,Isabelle Compagnon,Abdul-Rahman Allouche Journal of Molecular Modeling, 2016, 22 (11), ⟨10.1007/s00894-016-3135-5⟩ Article dans une revue hal-01673969v1
Photodissociation of Trapped Rb 2 + : Implications for Simultaneous Trapping of Atoms and Molecular Ions S. Jyothi,Tridib Ray,Sourav Dutta,Abdul-Rahman Allouche,Romain Vexiauet al. Physical Review Letters, 2016, 117 (21), ⟨10.1103/PhysRevLett.117.213002⟩ Article dans une revue hal-01673968v1
Fast radiative cooling of anthracene: Dependence on internal energy S. Martin,M. Ji,J. Bernard,R. Brédy,B. Concinaet al. Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2015, 92 (5), ⟨10.1103/PhysRevA.92.053425⟩ Article dans une revue hal-01673975v1
PAH radiative cooling and fragmentation kinematics studied within an electrostatic ring R. Brédy,C. Ortega,J. Ji,C. Chen,J. Bernardet al. Journal of Physics: Conference Series, 2015, 583, ⟨10.1088/1742-6596/583/1/012042⟩ Article dans une revue hal-01673979v1
Theoretical investigation on electronic, optical, and charge transport properties of new anthracene derivatives A. Touhami,R. Ben Chaabane,Abdul-Rahman Allouche Computational and Theoretical Chemistry, 2015, 1073, pp.123 - 130. ⟨10.1016/j.comptc.2015.09.024⟩ Article dans une revue hal-01673973v1
Atomistic Mechanisms for the Nucleation of Aluminum Oxide Nanoparticles Julien Lam,David Amans,Christophe Dujardin,Gilles Ledoux,Abdul-Rahman Allouche Journal of Physical Chemistry A, 2015, 119 (33), pp.8944 - 8949. ⟨10.1021/acs.jpca.5b05829⟩ Article dans une revue hal-01673976v1
High-lying electronic states of the rubidium dimer— Ab initio predictions and experimental observation of the 51Σu+ and 5 1 Π u states of Rb 2 by polarization labelling spectroscopy Wlodzimierz Jastrzebski,Pawel Kowalczyk,Jacek Szczepkowski,Abdul-Rahman Allouche,Patrick Crozetet al. The Journal of Chemical Physics, 2015, 143 (4), ⟨10.1063/1.4927225⟩ Article dans une revue hal-01673977v1
The cooling of naphthalene cations studied within an electrostatic storage ring C. Ortega,R. Brédy,C. Chen,J. Bernard,M Jiet al. Journal of Physics: Conference Series, 2015, 583, ⟨10.1088/1742-6596/583/1/012038⟩ Article dans une revue hal-01673981v1
Anharmonic simulations of the vibrational spectrum of sulfated compounds : application to the glycosaminoglycan fragment glucosamine 6-sulfate. Loïc Barnes,Baptiste Schindler,Abdul-Rahman Allouche,Daniel Simon,Stéphane Chambertet al. Physical Chemistry Chemical Physics, 2015, 17 (39), pp.25705-25713. ⟨10.1039/C5CP02079D⟩ Article dans une revue hal-01478808v1
TDDFT Assessment of Functionals for Optical 0–0 Transitions in Small Radicals Loïc Barnes,Saleh Abdul-Al,Abdul-Rahman Allouche Journal of Physical Chemistry A, 2014, 118 (46), pp.11033 - 11046. ⟨10.1021/jp5078032⟩ Article dans une revue hal-01673983v1
Distinguishing isobaric phosphated and sulfated carbohydrates by coupling of mass spectrometry with gas phase vibrational spectroscopy. Baptiste Schindler,Janhavi Joshi,Abdul-Rahman Allouche,Daniel Simon,Stéphane Chambertet al. Physical Chemistry Chemical Physics, 2014, 16 (40), pp.22131-22138. ⟨10.1039/C4CP02898H⟩ Article dans une revue hal-01407397v1
Observation of the 4(1)Sigma(+)(g) State of Rb-2 X. Han,J. Yang,Y. Guan,Z. Zhou,W. Zhaoet al. Chemical Physics Letters, 2014, 601, pp.124-127. ⟨10.1016/j.cplett.2014.04.003⟩ Article dans une revue istex hal-02310843v1
Vacuum ultraviolet action spectroscopy of polysaccharides. Quentin Enjalbert,Claire Brunet,Arnaud Vernier,Abdul-Rahman Allouche,Rodolphe Antoineet al. Journal of The American Society for Mass Spectrometry, 2013, 24 (8), pp.1271-1279. ⟨10.1007/s13361-013-0657-2⟩ Article dans une revue hal-00864641v1
Theoretical investigation of the lithium 2 p ← 2 s photoabsorption spectra perturbed by atomic hydrogen N. Lamoudi,M. Bouledroua,K. Alioua,Abdul-Rahman Allouche,Monique Aubert-Frécon Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2013, 87 (5), ⟨10.1103/PhysRevA.87.052713⟩ Article dans une revue hal-01673988v1
Upper bound to the ionization energy of 85 Rb 2 M. Bellos,R. Carollo,J. Banerjee,M. Ascoli,Abdul-Rahman Alloucheet al. Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2013, 87 (1), ⟨10.1103/PhysRevA.87.012508⟩ Article dans une revue hal-01673990v1
Transition dipole moments between the low-lying Ω g,u (+/−) states of the Rb 2 and Cs 2 molecules Abdul-Rahman Allouche,Monique Aubert-Frécon The Journal of Chemical Physics, 2012, 136 (11), ⟨10.1063/1.3694014⟩ Article dans une revue hal-01673993v1
Combined electrospray ionization source with a velocity map imaging spectrometer for studying large gas phase molecular ions E. Papalazarou,C. Cauchy,T. Barillot,B. Bellina,J. Maurelliet al. Analyst, 2012, 137 (15), ⟨10.1039/C2AN16136B⟩ Article dans une revue hal-01673995v1
Gas phase photo-formation and vacuum UV photofragmentation spectroscopy of tryptophan and tyrosine radical-containing peptides. Claire Brunet,Rodolphe Antoine,Abdul-Rahman Allouche,Philippe Dugourd,Francis Canonet al. Journal of Physical Chemistry A, 2011, 115 (32), pp.8933-9. ⟨10.1021/jp205617x⟩ Article dans une revue hal-01228312v1
Fragmentation of singly charged adenine induced by neutral fluorine beam impact at 3 keV Lin Chen,R. Brédy,J. Bernard,G. Montagne,Abdul-Rahman Alloucheet al. The Journal of Chemical Physics, 2011, 135 (11), ⟨10.1063/1.3621713⟩ Article dans une revue hal-01674001v1
Spectroscopic Signatures of Peptides Containing Tryptophan Radical Cations Bruno Bellina,Isabelle Compagnon,Sarah Houver,Philippe Maître,Abdul-Rahman Alloucheet al. Angewandte Chemie, 2011, 123 (48), pp.11632 - 11634. ⟨10.1002/anie.201104783⟩ Article dans une revue istex hal-01673996v1
Optimization of metabolite basis sets prior to quantitation in magnetic resonance spectroscopy: an approach based on quantum mechanics A Lazariev,Abdul-Rahman Allouche,M. Aubert-Frécon,F. Fauvelle,M. Piottoet al. Measurement Science and Technology, 2011, 22 (11), ⟨10.1088/0957-0233/22/11/114020⟩ Article dans une revue istex hal-01674000v1
Density functional theory (DFT) calculations of the proton nuclear magnetic resonance (NMR) spin-Hamiltonian parameters for serine Z Atieh,Abdul-Rahman Allouche,D. Graveron-Demilly,M. Aubert-Frécon Measurement Science and Technology, 2011, 22 (11), ⟨10.1088/0957-0233/22/11/114015⟩ Article dans une revue istex hal-01673998v1
Gabedit-A graphical user interface for computational chemistry softwares Abdul-Rahman Allouche Journal of Computational Chemistry, 2011, 32 (1), pp.174 - 182. ⟨10.1002/jcc.21600⟩ Article dans une revue hal-01674005v1
Ab initio and long-range investigation of the Ω (+/−) states of NaK dissociating adiabatically up to Na(3 s 2 S 1/2 ) + K(3 d 2 D 3/2 ) Abdul-Rahman Allouche,M. Aubert-Frécon The Journal of Chemical Physics, 2011, 135 (2), ⟨10.1063/1.3607964⟩ Article dans une revue hal-01674002v1
DFT calculations of 1H chemical shifts, simulated and experimental NMR spectra for sarcosine Z. Atieh,Abdul-Rahman Allouche,A. Lazariev,D. van Ormondt,D. Graveron-Demillyet al. Chemical Physics Letters, 2010, 492 (4-6), pp.297 - 301. ⟨10.1016/j.cplett.2010.04.054⟩ Article dans une revue istex hal-01674015v1
Rapid, Accurate and Simple Model to Predict NMR Chemical Shifts for Biological Molecules Zeinab Atieh,Monique Aubert-Frécon,Abdul-Rahman Allouche Journal of Physical Chemistry B, 2010, 114 (49), pp.16388 - 16392. ⟨10.1021/jp1086009⟩ Article dans une revue hal-01674013v1
UV spectroscopy of entire proteins in the gas phase B. Bellina,I. Compagnon,L. Joly,F. Albrieux,Abdul-Rahman Alloucheet al. International Journal of Mass Spectrometry, 2010, 297 (1-3), pp.36 - 40. ⟨10.1016/j.ijms.2010.05.015⟩ Article dans une revue istex hal-01674014v1
Photodetachment of tryptophan anion: an optical probe of remote electron Isabelle Compagnon,Abdul-Rahman Allouche,Franck Bertorelle,Rodolphe Antoine,Philippe Dugourd Physical Chemistry Chemical Physics, 2010, 12 (14), ⟨10.1039/B922514P⟩ Article dans une revue istex hal-01674016v1
UV electronic excitations in acidic sugars A. Racaud,Abdul-Rahman Allouche,R. Antoine,J. Lemoine,P. Dugourd Journal of Molecular Structure: THEOCHEM, 2010, 960 (1-3), pp.51 - 56. ⟨10.1016/j.theochem.2010.08.024⟩ Article dans une revue hal-01674011v1
Theoretical investigation of the Omega(g,u)(+/-) states of K2 dissociating adiabatically up to K(4p 2P(3/2)) + K(4p 2P(3/2)). Alya Jraij,Abdul-Rahman Allouche,Sylvie Magnier,Monique Aubert-Frécon The Journal of Chemical Physics, 2009, 130 (24), pp.244307. ⟨10.1063/1.3158361⟩ Article dans une revue hal-00667163v1
Density functional theory calculations of the nuclear magnetic resonance spin-Hamiltonian parameters for two polyamines of prostate tissue: spermidine and spermine Z Atieh,Abdul-Rahman Allouche,D. Graveron-Demilly,F. Fauvelle,M. Aubert-Frécon Measurement Science and Technology, 2009, 20 (10), ⟨10.1088/0957-0233/20/10/104024⟩ Article dans une revue istex hal-01674018v1
Optical properties of isolated hormone oxytocin dianions. Ionization, reduction and copper complexation effects Laure Joly,Rodolphe Antoine,Abdul-Rahman Allouche,Michel Broyer,Jérôme Lemoineet al. Journal of Physical Chemistry A, 2009, 113 (24), pp.6607-6611. ⟨10.1021/jp810342s⟩ Article dans une revue hal-02982077v1
Electron photodetachment of trapped doubly deprotonated angiotensin peptides. UV spectroscopy and radical recombination R. Antoine,L. Joly,Abdul-Rahman Allouche,M. Broyer,J. Lemoineet al. The European Physical Journal D : Atomic, molecular, optical and plasma physics, 2009, 51 (1), pp.117 - 124. ⟨10.1140/epjd/e2008-00076-4⟩ Article dans une revue istex hal-01674028v1
Ab initio potential energy curves and transition dipole moments for the interaction of a ground state He with Na(3s–3p) Abdul-Rahman Allouche,K. Alioua,M. Bouledroua,M. Aubert-Frécon Chemical Physics, 2009, 355 (1), pp.85 - 89. ⟨10.1016/j.chemphys.2008.11.006⟩ Article dans une revue hal-01674022v1
Theoretical electronic structure of the molecule ScI M. Korek,S. Kontar,F. Taher-Mansour,Abdul-Rahman Allouche International Journal of Quantum Chemistry, 2009, 109 (2), pp.236 - 242. ⟨10.1002/qua.21779⟩ Article dans une revue istex hal-01674025v1
DFT calculations of NMR spin-hamiltonian parameters for two polyamines of prostate tissue: Spermidine and spermine Z. Atieh,A. R. Allouche,D. Graveron-Demilly,F. Fauvelle,M. Aubert-Frécon Measurement Science and Technology, 2009, 20, (in-press) Article dans une revue hal-00443119v1
Self-broadening and shifting of the Li(2s–2p) and K(4s–4p) line cores L. Reggami,M. Bouledroua,Abdul-Rahman Allouche,M. Aubert-Frécon Journal of Quantitative Spectroscopy and Radiative Transfer, 2009, 110 (1-2), pp.72 - 81. ⟨10.1016/j.jqsrt.2008.09.011⟩ Article dans une revue hal-01674021v1
Coincidence method for measuring the mass of neutral fragments emitted in a delayed fragmentation process from a singly charged molecule: Fragmentation pathway of adenine S. Martin,R. Brédy,Abdul-Rahman Allouche,J. Bernard,A. Salmounet al. Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2008, 77 (6), ⟨10.1103/PhysRevA.77.062513⟩ Article dans une revue hal-01674041v1
Far-wing profile of photoabsorption spectra of Na(3s–3p) atoms perturbed by helium K Alioua,M Bouledroua,Abdul-Rahman Allouche,M. Aubert-Frécon Journal of Physics B: Atomic, Molecular and Optical Physics, 2008, 41 (17), ⟨10.1088/0953-4075/41/17/175102⟩ Article dans une revue istex hal-01674038v1
Theoretical spin-orbit structure of the alkali dimer cation K2+ Alya Jraij,Abdul-Rahman Allouche,Sylvie Magnier,Monique Aubert-Frécon Canadian Journal of Physics, 2008, 86 (12), pp.1409-1415. ⟨10.1139/P08-091⟩ Article dans une revue hal-00675168v1
Theoretical electronic structure of the lowest-lying states of ScCl molecule below 22500cm−1 F. Taher-Mansour,Abdul-Rahman Allouche,M. Korek Journal of Molecular Spectroscopy, 2008, 248 (1), pp.61 - 65. ⟨10.1016/j.jms.2007.11.012⟩ Article dans une revue istex hal-01674043v1
Theoretical and experimental investigation of the 1H NMR spectrum of putrescine A. R. Allouche,D. Graveron-Demilly,F. Fauvelle,M. Aubert-Frécon Chemical Physics Letters, 2008, 466 (4-6), pp.219--222 Article dans une revue hal-00443106v1
Theoretical study with spin-orbit effects and electronic transition moment calculation of the ion NaCs + K Korek,K Badreddine,Abdul-Rahman Allouche Canadian Journal of Physics, 2008, 86 (8), pp.1015 - 1022. ⟨10.1139/p08-023⟩ Article dans une revue hal-01674039v1
Theoretical calculation of the low lying electronic states of the molecular ion RbH+ with spin-orbit effects M. Korek,S. Hammoud,Abdul-Rahman Allouche,T. Harb The Journal of Chemical Physics, 2008, 129 (20), ⟨10.1063/1.2992074⟩ Article dans une revue hal-01674032v1
Photoelectron Spectroscopy of Gramicidin Polyanions: Competition between Delayed and Direct Emission Katerina Matheis,Laure Joly,Rodolphe Antoine,Franck Lépine,C. Bordaset al. Journal of the American Chemical Society, 2008, 130 (47), pp.15903-15906. ⟨10.1021/ja803758w⟩ Article dans une revue istex hal-00391920v1
Theoretical calculation of the low laying electronic states of the molecule NaCs with spin-orbit effect M. Korek,S. Bleik,Abdul-Rahman Allouche The Journal of Chemical Physics, 2007, 126 (12), ⟨10.1063/1.2710257⟩ Article dans une revue hal-01674047v1
Theoretical structure of the low-laying electronic states of the molecule YBr S. Abdul-Al,M. Korek,Abdul-Rahman Allouche,M. Aubert Frécon International Journal of Quantum Chemistry, 2007, 107 (4), pp.998 - 1007. ⟨10.1002/qua.21199⟩ Article dans une revue istex hal-01674048v1
Ultraviolet Spectroscopy of Peptide and Protein Polyanions in Vacuo: Signature of the Ionization State of Tyrosine Laure Joly,Rodolphe Antoine,Abdul-Rahman Allouche,Michel Broyer,Jérôme Lemoineet al. Journal of the American Chemical Society, 2007, 129 (27), pp.8428 - 8429. ⟨10.1021/ja072818r⟩ Article dans une revue istex hal-01674046v1
Quantum chemistry-based NMR spin Hamiltonian parameters of GABA for quantitation in magnetic resonance spectroscopy Abdul-Rahman Allouche,M. Aubert-Frécon,D. Graveron-Demilly Physical Chemistry Chemical Physics, 2007, 9 (24), pp.3098 - 3103. ⟨10.1039/B700631D⟩ Article dans une revue istex hal-01674050v1
Ab initio Study of Neutral and Charged Si n Na p (+) ( n ≤ 6, p ≤ 2) Clusters C. Sporea,Franck Rabilloud,Abdul-Rahman Allouche,M. Frécon Journal of Physical Chemistry A, 2006, 110 (3), pp.1046 - 1051. ⟨10.1021/jp055014b⟩ Article dans une revue istex hal-01674058v1
Structure of low-lying electronic states of NdO: Quantum chemical calculations Abdul-Rahman Allouche,M. Aubert-Frécon,S. Ya. Umanskiy The Journal of Chemical Physics, 2006, 124 (18), ⟨10.1063/1.2189232⟩ Article dans une revue hal-01674052v1
Theoretical study with rovibrational and electronic transitionmoment calculation of the ion LiCs + M Korek,a M Moghrabi,Abdul-Rahman Allouche,M Aubert Frécon Canadian Journal of Physics, 2006, 84 (11), pp.959 - 971. ⟨10.1139/p06-073⟩ Article dans une revue hal-01674051v1
Electric dipole, polarizability and structure of cesium chloride clusters with one-excess electron A. Jraij,Abdul-Rahman Allouche,Franck Rabilloud,M. Korek,M. Aubert-Fréconet al. Chemical Physics, 2006, 322 (3), pp.298 - 302. ⟨10.1016/j.chemphys.2005.09.033⟩ Article dans une revue hal-01674054v1
Theoretical Study of Mixed Silicon−Lithium Clusters Si n Li p (+) ( n = 1−6, p = 1−2) C. Sporea,Franck Rabilloud,X. Cosson,Abdul-Rahman Allouche,M. Aubert-Frécon Journal of Physical Chemistry A, 2006, 110 (18), pp.6032 - 6038. ⟨10.1021/jp0567927⟩ Article dans une revue istex hal-01674053v1
Theoretical calculation of the excited states of the KCs molecule including the spin-orbit interaction M. Korek,Y. A. Moghrabi,Abdul-Rahman Allouche The Journal of Chemical Physics, 2006, 124 (9), ⟨10.1063/1.2173239⟩ Article dans une revue hal-01674055v1
Theoretical electronic structure including spin–orbit effects of the alkali dimer cation A. Jraij,Abdul-Rahman Allouche,M. Korek,M. Aubert-Frécon Chemical Physics, 2005, 310 (1-3), pp.145 - 151. ⟨10.1016/j.chemphys.2004.10.023⟩ Article dans une revue istex hal-01674063v1
Electronic properties of mixed lithium-oxygen clusters J. Viallon,M. Lebeault,F. Lepine,J. Chevaleyre,Christian Joninet al. The European Physical Journal D : Atomic, molecular, optical and plasma physics, 2005, 33 (3), pp.405 - 411. ⟨10.1140/epjd/e2005-00075-y⟩ Article dans une revue istex hal-01674060v1
Theoretical electronic structure of the lowest-lying states of the YI molecule S. Abdul-Al,Abdul-Rahman Allouche,M. Korek,M. Aubert-Frécon Chemical Physics, 2005, 308 (1-2), pp.1 - 6. ⟨10.1016/j.chemphys.2004.07.032⟩ Article dans une revue istex hal-01674064v1
Theoretical structure of the low lying electronic states of yttrium fluoride YF S. Abdul-Al,M. Korek,Abdul-Rahman Allouche,M. Aubert Frécon Chemical Physics, 2005, 315 (1-2), pp.183 - 192. ⟨10.1016/j.chemphys.2005.03.024⟩ Article dans une revue istex hal-01674059v1
Existence of weakly bound states for metal-benzene molecules confirmed from a long-range model M. Aubert-Frecon,Franck Rabilloud,Abdul-Rahman Allouche,D. Rayane,R. Antoineet al. Chemical Physics Letters, 2005, 405 (4-6), pp.422-424. ⟨10.1016/j.cplett.2005.02.071⟩ Article dans une revue istex hal-00143854v1
Theoretical electronic structure of the lowest-lying states of the LaCl molecule H. Fahs,M. Korek,Abdul-Rahman Allouche,M. Aubert-Frécon Chemical Physics, 2004, 299 (1), pp.97 - 103. ⟨10.1016/j.chemphys.2003.12.009⟩ Article dans une revue istex hal-01674070v1
Theoretical determination of highly excited states of K2 correlated adiabatically above K(4p)+K(4p) S. Magnier,M. Aubert-Frécon,Abdul-Rahman Allouche The Journal of Chemical Physics, 2004, 121 (4), pp.1771 - 1781. ⟨10.1063/1.1764498⟩ Article dans une revue hal-01674068v1
Static anisotropic and isotropic electric dipole polarizabilities of Na n F n-1 clusters Geoffroy Durand,F. Spiegelman,Abdul-Rahman Allouche The European Physical Journal D : Atomic, molecular, optical and plasma physics, 2003, 24 (1-3), pp.19 - 22. ⟨10.1140/epjd/e2003-00163-0⟩ Article dans une revue istex hal-01674077v1
Theoretical electronic structure of the alkali-dimer cation Rb2+ A. Jraij,Abdul-Rahman Allouche,M. Korek,M. Aubert-Frécon Chemical Physics, 2003, 290 (2-3), pp.129 - 136. ⟨10.1016/S0301-0104(03)00060-0⟩ Article dans une revue istex hal-01674078v1
Theoretical study of the low-lying electronic states of the molecular ion KRb+ M. Korek,G. Younes,Abdul-Rahman Allouche International Journal of Quantum Chemistry, 2003, 92 (4), pp.376 - 380. ⟨10.1002/qua.10485⟩ Article dans une revue istex hal-01674083v1
Structural electric dipole in small ionic nanocrystals D. Rayane,A. R. Allouche,I. Compagnon,R. Antoine,M. Aubert-Fréconet al. Chemical Physics Letters, 2003, 367 (3-4), pp.278-283. ⟨10.1016/S0009-2614(02)01696-2⟩ Article dans une revue istex hal-00152695v1
Theoretical electronic structure of the lowest-lying states of the LaI molecule F. Taher-Mansour,Abdul-Rahman Allouche,M. Aubert-Frécon Journal of Molecular Spectroscopy, 2003, 221 (1), pp.1 - 6. ⟨10.1016/S0022-2852(03)00151-6⟩ Article dans une revue istex hal-01674072v1
Electric dipole of metal-benzene sandwiches D. Rayane,Abdul-Rahman Allouche,Rodolphe Antoine,M. Broyer,I. Compagnonet al. Chemical Physics Letters, 2003, 375 (5-6), pp.506-510. ⟨10.1016/S0009-2614(03)00870-4⟩ Article dans une revue istex hal-00152691v1
Susceptibility and electric dipole in metal C&lt;sub&gt;60&lt;/sub&gt; compounds D. Rayane,A. R. Allouche,R. Antoine,I. Compagnon,M. Broyeret al. The European Physical Journal D : Atomic, molecular, optical and plasma physics, 2003, 24, (1-3), pp.9-13. ⟨10.1140/epjd/e2003-00134-5⟩ Article dans une revue istex hal-00152687v1
Permanent dipole of metal-benzene molecules : Evidence for long-range weakly bound states ? F. Rabilloud,D. Rayane,A. R. Allouche,R. Antoine,M. Aubert-Fréconet al. Journal of Physical Chemistry A, 2003, 107 (51), pp.11347-11353. ⟨10.1021/jp035403a⟩ Article dans une revue istex hal-00152663v1
Theoretical electronic structure of the lowest-lying states of the LaF molecule H. Fahs,Abdul-Rahman Allouche,M. Korek,M. Aubert-Frécon The Journal of Chemical Physics, 2002, 117 (8), pp.3715 - 3720. ⟨10.1063/1.1493769⟩ Article dans une revue hal-01674088v1
Electric dipole moments and polarizabilities of single excess electron sodium fluoride clusters: Experiment and theory D. Rayane,I. Compagnon,R. Antoine,M. Broyer,P. Dugourdet al. The Journal of Chemical Physics, 2002, 116 (24), pp.10730-10738. ⟨10.1063/1.1480595⟩ Article dans une revue hal-00152747v1
Computed Electron Affinity of Carbon Clusters C n up to n = 20 and Fragmentation Energy of Anions F. Lepine,Abdul-Rahman Allouche,B. Baguenard,Ch. Bordas,M. Aubert-Frécon Journal of Physical Chemistry A, 2002, 106 (31), pp.7177 - 7183. ⟨10.1021/jp014701+⟩ Article dans une revue hal-01674090v1
The theoretical spin-orbit structure of the RbCs molecule H Fahs,Abdul-Rahman Allouche,M Korek,M. Aubert-Frécon Journal of Physics B: Atomic, Molecular and Optical Physics, 2002, 35 (6), pp.1501 - 1508. ⟨10.1088/0953-4075/35/6/307⟩ Article dans une revue istex hal-01674093v1
Potential curves and rovibrational energies for electronic states of the molecular ion KCs + M Korek,Abdul-Rahman Allouche,S N Abdul Al Canadian Journal of Physics, 2002, 80 (9), pp.1025 - 1035. ⟨10.1139/p02-045⟩ Article dans une revue hal-01674087v1
Emission of singly and doubly charged light fragments from C 60 r + ( r = 4 – 9 ) in Xe 2 5 + − C 60 collisions S. Martin,Lin Chen,R. Brédy,J. Bernard,M. C. Buchet-Poulizacet al. Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2002, 66 (6), ⟨10.1103/PhysRevA.66.063201⟩ Article dans une revue hal-01674084v1
Theoretical study of the low-lying electronic states of the RbCs + molecular ion M Korek,Abdul-Rahman Allouche Journal of Physics B: Atomic, Molecular and Optical Physics, 2001, 34 (18), pp.3689 - 3702. ⟨10.1088/0953-4075/34/18/307⟩ Article dans une revue istex hal-01674097v1
Pure long-range ion-pair Cs2 molecules T Ban,S Skenderović,R Beuc,I Krajcar Bronić,S Rousseauet al. Chemical Physics Letters, 2001, 345 (5-6), pp.423 - 428. ⟨10.1016/S0009-2614(01)00918-6⟩ Article dans une revue istex hal-01674094v1
Polarizability of KC 60 : Evidence for Potassium Skating on the C 60 Surface D. Rayane,R. Antoine,Ph. Dugourd,E. Benichou,Abdul-Rahman Alloucheet al. Physical Review Letters, 2000, 84 (9), pp.1962 - 1965. ⟨10.1103/PhysRevLett.84.1962⟩ Article dans une revue hal-01674110v1
Non perturbative approach for a polar and polarizable linear molecule in an inhomogeneous electric field: Application to molecular beam deviation experiments Emmanuel Benichou,Abdul-Rahman Allouche,Rodolphe Antoine,Monique Aubert-Frecon,Mickaël Bourgoinet al. The European Physical Journal D : Atomic, molecular, optical and plasma physics, 2000, 10 (2), pp.233-242. ⟨10.1007/s100530050544⟩ Article dans une revue hal-00492376v1
Theoretical Study of the Electronic Structure of the KRb Molecule S. Rousseau,Abdul-Rahman Allouche,M. Aubert-Frécon Journal of Molecular Spectroscopy, 2000, 203 (2), pp.235 - 243. ⟨10.1006/jmsp.2000.8142⟩ Article dans une revue istex hal-01674100v1
Theoretical study of the electronic structure of LiCs, NaCs, and KCs molecules K Korek,Abdul-Rahman Allouche,K Fakhreddine,A Chaalan Canadian Journal of Physics, 2000, 78 (11), pp.977 - 988. ⟨10.1139/p00-074⟩ Article dans une revue hal-01674098v1
Theoretical study of the electronic structure of the LiRb and NaRb molecules M. Korek,Abdul-Rahman Allouche,M. Kobeissi,A. Chaalan,M. Dagheret al. Chemical Physics, 2000, 256 (1), pp.1 - 6. ⟨10.1016/S0301-0104(00)00061-6⟩ Article dans une revue istex hal-01674103v1
Electronic properties of mixed barium–oxygen clusters V. Boutou,M. A. Lebeault,Abdul-Rahman Allouche,F. Paulig,J. Viallonet al. The Journal of Chemical Physics, 2000, 112 (14), pp.6228 - 6236. ⟨10.1063/1.481221⟩ Article dans une revue hal-01674107v1
Theoretical electronic structure of RbCs revisited Abdul-Rahman Allouche,M Korek,F Fakherddin,A Chaalan,M Dagheret al. Journal of Physics B: Atomic, Molecular and Optical Physics, 2000, 33 (12), pp.2307 - 2316. ⟨10.1088/0953-4075/33/12/312⟩ Article dans une revue istex hal-01674102v1
Potential energy curves of 58 states of Li2+ M Magnier,S Rousseau,Abdul-Rahman Allouche,G. Hadinger,M. Aubert-Frécon Chemical Physics, 1999, 246 (1-3), pp.57 - 64. ⟨10.1016/S0301-0104(99)00084-1⟩ Article dans une revue istex hal-01674115v1
Theoretical study of the electronic structure of KLi and comparison with experiments S. Rousseau,Abdul-Rahman Allouche,M. Aubert-Frécon,S. Magnier,P. Kowalczyket al. Chemical Physics, 1999, 247 (2), pp.193 - 199. ⟨10.1016/S0301-0104(99)00206-2⟩ Article dans une revue istex hal-01674114v1
Static dipole polarizability of small mixed sodium–lithium clusters R. Antoine,D. Rayane,Abdul-Rahman Allouche,M. Aubert-Frécon,E. Benichouet al. The Journal of Chemical Physics, 1999, 110 (12), pp.5568 - 5577. ⟨10.1063/1.478455⟩ Article dans une revue hal-01674116v1
Static electric dipole polarizabilities of alkali clusters D. Rayane,Abdul-Rahman Allouche,E. Benichou,R. Antoine,M. Aubert-Fréconet al. The European Physical Journal D : Atomic, molecular, optical and plasma physics, In press, 9 (1), pp.243 - 248. ⟨10.1007/s100530050433⟩ Article dans une revue istex hal-01674111v1
Experimental and theoretical investigations of ionization potentials and structures of mixed sodium lithium clusters E. Benichou,Abdul-Rahman Allouche,M. Aubert-Frécon,R. Antoine,M. Broyeret al. Chemical Physics Letters, 1998, 290 (1-3), pp.171 - 179. ⟨10.1016/S0009-2614(98)00513-2⟩ Article dans une revue istex hal-01674117v1
Predictions of geometrical structures and ionization potentials for small barium clusters Ba $_{\mathsf{ n}}$ V. Boutou,Abdul-Rahman Allouche,F. Spiegelmann,J. Chevaleyre,M. Aubert Frécon The European Physical Journal D : Atomic, molecular, optical and plasma physics, 1998, 2 (1), pp.63 - 73. ⟨10.1007/s100530050112⟩ Article dans une revue istex hal-01674118v1
Structural Transition in Barium Suboxide Clusters V. Boutou,M. A. Lebeault,Abdul-Rahman Allouche,C. Bordas,F. Pauliget al. Physical Review Letters, 1998, 80 (13), pp.2817 - 2820. ⟨10.1103/PhysRevLett.80.2817⟩ Article dans une revue hal-01674119v1
Ionization potentials and geometrical structure of pure and oxygenated barium clusters V. Boutou,M. A. Lebeault-Dorget,Abdul-Rahman Allouche,C. Bordas,J. Chevaleyre Zeitschrift für Physik. D, Atoms, molecules and clusters, 1997, 40 (1-4), pp.448 - 453. ⟨10.1007/s004600050249⟩ Article dans une revue istex hal-01674120v1
Theoretical study of the electronic structure of the low-lying states of the Li 2 H molecule Abdul-Rahman Allouche,M. Aubert-Frécon,F. Spiegelmann Canadian Journal of Physics, 1996, 74 (5-6), pp.194 - 201. ⟨10.1139/p96-031⟩ Article dans une revue hal-01674124v1
On the optical absorption spectrum of Li2H R. Antoine,Ph. Dugourd,D. Rayane,Abdul-Rahman Allouche,M. Aubert-Fréconet al. Chemical Physics Letters, 1996, 261 (6), pp.670 - 676. ⟨10.1016/0009-2614(96)01027-5⟩ Article dans une revue istex hal-01674121v1
Theoretical study of the electronic structure of the Sr2 molecule Nabil Boutassetta,Abdul-Rahman Allouche,Monique Aubert-Frécon Physical Review A : Atomic, molecular, and optical physics [1990-2015], 1996, 53 (6), pp.3845-3852. ⟨10.1103/PhysRevA.53.3845⟩ Article dans une revue hal-01674122v1
Theoretical study of some low-lying states of scandium monochloride N Boutassetta,Abdul-Rahman Allouche,M. Aubert-Frécon Journal of Physics B: Atomic, Molecular and Optical Physics, 1996, 29 (9), pp.1637 - 1639. ⟨10.1088/0953-4075/29/9/010⟩ Article dans une revue istex hal-01674123v1
Theoretical study of the electronic structure of the Ba2 molecule Abdul-Rahman Allouche,M. Aubert-Frécon,G. Nicolas,F. Spiegelmann Chemical Physics, 1995, 200 (1-2), pp.63 - 77. ⟨10.1016/0301-0104(95)00204-2⟩ Article dans une revue istex hal-01674126v1
Theoretical study of the low-lying electronic states of the BaK molecule N. Boutassetta,Abdul-Rahman Allouche,M. Aubert-Frécon Chemical Physics, 1995, 201 (2-3), pp.393 - 403. ⟨10.1016/0301-0104(95)00301-0⟩ Article dans une revue istex hal-01674125v1
A Ligand Field Approach for the Low-Lying States of Ca, Sr, and Ba Monohydroxides Abdul-Rahman Allouche,M. Aubertfrecon Journal of Molecular Spectroscopy, 1994, 163 (2), pp.599 - 603. ⟨10.1006/jmsp.1994.1049⟩ Article dans une revue istex hal-01674129v1
Ab initio treatment of electron capture by B 4 + ions from atomic hydrogen F. Fraija,Abdul-Rahman Allouche,M. C. Bacchus-Montabonel Physical Review A : Atomic, molecular, and optical physics [1990-2015], 1994, 49 (1), pp.272 - 276. ⟨10.1103/PhysRevA.49.272⟩ Article dans une revue hal-01674131v1
Theoritical study of low-lying electronic states of the CaLi molecule Abdul-Rahman Allouche,M. Aubert-Frécon Chemical Physics Letters, 1994, 222 (5), pp.524 - 528. ⟨10.1016/0009-2614(94)00371-8⟩ Article dans une revue istex hal-01674128v1
Theoretical study of the low-lying electronic states of the BaNa molecule N. Boutassetta,Abdul-Rahman Allouche,M. Aubert-Frécon Chemical Physics, 1994, 189 (1), pp.33 - 39. ⟨10.1016/0301-0104(94)80005-7⟩ Article dans une revue istex hal-01674127v1
Electronic structure of BaLi. I. Theoretical study Abdul-Rahman Allouche,M. Aubert‐frécon The Journal of Chemical Physics, 1994, 100 (2), pp.938 - 944. ⟨10.1063/1.466575⟩ Article dans une revue hal-01674130v1
A ligand-field approach for the low-lying states of Ca, Sr and Ba monohalides Abdul-Rahman Allouche,G. Wannous,M. Aubert-Frécon Chemical Physics, 1993, 170 (1), pp.11 - 22. ⟨10.1016/0301-0104(93)80087-P⟩ Article dans une revue istex hal-01674133v1
Theoretical study of the low-lying electronic states of the BaH+ molecular ion Abdul-Rahman Allouche,F. Spiegelmann,M. Aubert-Frécon Chemical Physics Letters, 1993, 204 (3-4), pp.343 - 349. ⟨10.1016/0009-2614(93)90020-2⟩ Article dans une revue istex hal-01674132v1
The B' 2 Delta state of CaF J. Vergés,C. Effantin,A Bernard,A Topouzkhanian,Abdul-Rahman Alloucheet al. Journal of Physics B: Atomic, Molecular and Optical Physics, 1993, 26 (2), pp.279 - 284. ⟨10.1088/0953-4075/26/2/011⟩ Article dans une revue istex hal-01674134v1
Theoretical study of the electronic structure of the BaH molecule Abdul-Rahman Allouche,G. Nicolas,J. C. Barthelat,F. Spiegelmann The Journal of Chemical Physics, 1992, 96 (10), pp.7646 - 7655. ⟨10.1063/1.462365⟩ Article dans une revue hal-01674135v1