Profil
Nom:
Name:
ALLOUCHE Abdul Rahman
Equipe(s):
Team(s):
- Physicochimie théorique
Position:
Enseignant-chercheur
Bureau(x):
Office(s):
- BRILLOUIN / 2ème / 12-015a
Mel:
Mail:
abdul-rahman.allouche@univ-lyon1.fr
Tél(s):
Phone(s):
- 0787099194
Optimization of metabolite basis sets prior to quantitation in magnetic resonance spectroscopy: an approach based on quantum mechanics
Measurement Science and Technology, vol. 22
(2011)
Gabedit-A graphical user interface for computational chemistry softwares
Journal of Computational Chemistry, vol. 32, p174 - 182
(2011)
Spectroscopic Signatures of Peptides Containing Tryptophan Radical Cations
Angewandte Chemie, vol. 123, p11632 - 11634
(2011)
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 )
The Journal of Chemical Physics, vol. 135
(2011)
DFT calculations of 1H chemical shifts, simulated and experimental NMR spectra for sarcosine
Chemical Physics Letters, vol. 492, p297 - 301
(2010)
Rapid, Accurate and Simple Model to Predict NMR Chemical Shifts for Biological Molecules
Journal of Physical Chemistry B, vol. 114, p16388 - 16392
(2010)
UV spectroscopy of entire proteins in the gas phase
International Journal of Mass Spectrometry, vol. 297, p36 - 40
(2010)
Photodetachment of tryptophan anion: an optical probe of remote electron
Physical Chemistry Chemical Physics, vol. 12
(2010)
UV electronic excitations in acidic sugars
Journal of Molecular Structure: THEOCHEM, vol. 960, p51 - 56
(2010)
Theoretical investigation of the Omega(g,u)(+/-) states of K2 dissociating adiabatically up to K(4p 2P(3/2)) + K(4p 2P(3/2)).
The Journal of Chemical Physics, vol. 130, p244307
(2009)
Optical properties of isolated hormone oxytocin dianions. Ionization, reduction and copper complexation effects
Journal of Physical Chemistry A, vol. 113, p6607-6611
(2009)
Density functional theory calculations of the nuclear magnetic resonance spin-Hamiltonian parameters for two polyamines of prostate tissue: spermidine and spermine
Measurement Science and Technology, vol. 20
(2009)
Electron photodetachment of trapped doubly deprotonated angiotensin peptides. UV spectroscopy and radical recombination
The European Physical Journal D : Atomic, molecular, optical and plasma physics, vol. 51, p117 - 124
(2009)
Ab initio potential energy curves and transition dipole moments for the interaction of a ground state He with Na(3s–3p)
Chemical Physics, vol. 355, p85 - 89
(2009)
Theoretical electronic structure of the molecule ScI
International Journal of Quantum Chemistry, vol. 109, p236 - 242
(2009)
Self-broadening and shifting of the Li(2s–2p) and K(4s–4p) line cores
Journal of Quantitative Spectroscopy and Radiative Transfer, vol. 110, p72 - 81
(2009)
Coincidence method for measuring the mass of neutral fragments emitted in a delayed fragmentation process from a singly charged molecule: Fragmentation pathway of adenine
Physical Review A : Atomic, molecular, and optical physics [1990-2015], vol. 77
(2008)
Theoretical spin-orbit structure of the alkali dimer cation K2+
Canadian Journal of Physics, vol. 86, p1409-1415
(2008)